ethyl 4-(5,6-dimethylbenzimidazol-1-yl)-3-(naphthalen-1-ylcarbonylamino)benzoate

Systemtic Name: ethyl 4-(5,6-dimethylbenzimidazol-1-yl)-3-(naphthalen-1-ylcarbonylamino)benzoate Openeye Name: ethyl 4-(5,6-dimethylbenzimidazol-1-yl)-3-(naphthalene-1-carbonylamino)benzoate CAS Name: 4-(5,6-dimethyl-1-benzimidazolyl)-3-[[1-naphthalenyl(oxo)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(5,6-dimethylbenzimidazol-1-yl)-3-(naphthalene-1-carbonylamino)benzoate Traditional Name: 4-(5,6-dimethylbenzimidazol-1-yl)-3-(1-naphthoylamino)benzoic acid ethyl ester Formula: C29H25N3O3 MolecularWeight: 463.5271

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2C=NC3=C2C=C(C(=C3)C)C)NC(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2C=NC3=C2C=C(C(=C3)C)C)NC(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H25N3O3/c1-4-35-29(34)21-12-13-26(32-17-30-24-14-18(2)19(3)15-27(24)32)25(16-21)31-28(33)23-11-7-9-20-8-5-6-10-22(20)23/h5-17H,4H2,1-3H3,(H,31,33)