ethyl 7-[3-(dimethylaminomethyl)phenyl]-1-phenyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 7-[3-(dimethylaminomethyl)phenyl]-1-phenyl-benzimidazole-5-carboxylate Openeye Name: ethyl 7-[3-(dimethylaminomethyl)phenyl]-1-phenyl-benzimidazole-5-carboxylate CAS Name: 7-[3-(dimethylaminomethyl)phenyl]-1-phenyl-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[3-(dimethylaminomethyl)phenyl]-1-phenylbenzimidazole-5-carboxylate Traditional Name: 7-[3-(dimethylaminomethyl)phenyl]-1-phenyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C(=C1)C3=CC(=CC=C3)CN(C)C)N(C=N2)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC2=C(C(=C1)C3=CC(=CC=C3)CN(C)C)N(C=N2)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O2/c1-4-30-25(29)20-14-22(19-10-8-9-18(13-19)16-27(2)3)24-23(15-20)26-17-28(24)21-11-6-5-7-12-21/h5-15,17H,4,16H2,1-3H3