methyl 2-[(2-methyl-3H-benzimidazol-5-yl)carbonyl]-3,4-dihydro-1H-isoquinoline-7-carboxylate

Systemtic Name: methyl 2-[(2-methyl-3H-benzimidazol-5-yl)carbonyl]-3,4-dihydro-1H-isoquinoline-7-carboxylate Openeye Name: methyl 2-(2-methyl-3H-benzimidazole-5-carbonyl)-3,4-dihydro-1H-isoquinoline-7-carboxylate CAS Name: 2-[(2-methyl-3H-benzimidazol-5-yl)-oxomethyl]-3,4-dihydro-1H-isoquinoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-methyl-3H-benzimidazole-5-carbonyl)-3,4-dihydro-1H-isoquinoline-7-carboxylate Traditional Name: 2-(2-methyl-3H-benzimidazole-5-carbonyl)-3,4-dihydro-1H-isoquinoline-7-carboxylic acid methyl ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1)C=C(C=C2)C(=O)N3CCC4=C(C3)C=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=NC2=C(N1)C=C(C=C2)C(=O)N3CCC4=C(C3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C20H19N3O3/c1-12-21-17-6-5-14(10-18(17)22-12)19(24)23-8-7-13-3-4-15(20(25)26-2)9-16(13)11-23/h3-6,9-10H,7-8,11H2,1-2H3,(H,21,22)