95T
Summary
Name: | 5-(4-chlorophenyl)-~{N}-(3,5-dimethoxyphenyl)furan-2-carboxamide |
Formula: | C19 H16 Cl N O4 |
Formal charge: | 0 |
Formula weight: | 357.788 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 5-(4-chlorophenyl)-~{N}-(3,5-dimethoxyphenyl)furan-2-carboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C19H16ClNO4/c1-23-15-9-14(10-16(11-15)24-2)21-19(22)18-8-7-17(25-18)12-3-5-13(20)6-4-12/h3-11H,1-2H3,(H,21,22) |
InChIKey | InChI | 1.03 | VHKBTPQDHDSBSP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(NC(=O)c2oc(cc2)c3ccc(Cl)cc3)cc(OC)c1 |
SMILES | CACTVS | 3.385 | COc1cc(NC(=O)c2oc(cc2)c3ccc(Cl)cc3)cc(OC)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1cc(cc(c1)OC)NC(=O)c2ccc(o2)c3ccc(cc3)Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1cc(cc(c1)OC)NC(=O)c2ccc(o2)c3ccc(cc3)Cl |