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709

Summary
Name:N-(7-CARBAMIMIDOYL-NAPHTHALEN-1-YL)-3-HYDROXY-2-METHYL-BENZAMIDE
Synonyms:N-{7-[AMINO(IMINO)METHYL]-1-NAPHTHYL}-3-HYDROXY-2-METHYLBENZAMIDE
Formula:C19 H17 N3 O2
Formal charge:0
Formula weight:319.357 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04N-(7-carbamimidoylnaphthalen-1-yl)-3-hydroxy-2-methylbenzamide
OpenEye OEToolkits1.5.0N-(7-carbamimidoylnaphthalen-1-yl)-3-hydroxy-2-methyl-benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(c1cccc(O)c1C)Nc3c2cc(C(=[N@H])N)ccc2ccc3
SMILES_CANONICALCACTVS3.341Cc1c(O)cccc1C(=O)Nc2cccc3ccc(cc23)C(N)=N
SMILESCACTVS3.341Cc1c(O)cccc1C(=O)Nc2cccc3ccc(cc23)C(N)=N
SMILES_CANONICALOpenEye OEToolkits1.5.0[H]/N=C(\c1ccc2cccc(c2c1)NC(=O)c3cccc(c3C)O)/N
SMILESOpenEye OEToolkits1.5.0[H]N=C(c1ccc2cccc(c2c1)NC(=O)c3cccc(c3C)O)N
InChIInChI1.03InChI=1S/C19H17N3O2/c1-11-14(5-3-7-17(11)23)19(24)22-16-6-2-4-12-8-9-13(18(20)21)10-15(12)16/h2-10,23H,1H3,(H3,20,21)(H,22,24)
InChIKeyInChI1.03NNGZRCYXFBHMRM-UHFFFAOYSA-N

219140

PDB entries from 2024-05-01

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