7Q0
Summary
Name: | N-(4-azanyl-1,2-dihydroacenaphthylen-5-yl)-4-fluoranyl-benzamide |
Formula: | C19 H15 F N2 O |
Formal charge: | 0 |
Formula weight: | 306.334 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-(4-azanyl-1,2-dihydroacenaphthylen-5-yl)-4-fluoranyl-benzamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C19H15FN2O/c20-14-8-6-12(7-9-14)19(23)22-18-15-3-1-2-11-4-5-13(17(11)15)10-16(18)21/h1-3,6-10H,4-5,21H2,(H,22,23) |
InChIKey | InChI | 1.06 | XFOBJVGGSATXHM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1cc2CCc3cccc(c1NC(=O)c4ccc(F)cc4)c23 |
SMILES | CACTVS | 3.385 | Nc1cc2CCc3cccc(c1NC(=O)c4ccc(F)cc4)c23 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c3c(c1)c(c(cc3CC2)N)NC(=O)c4ccc(cc4)F |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c3c(c1)c(c(cc3CC2)N)NC(=O)c4ccc(cc4)F |