dimethyl 5-[3-(benzimidazol-1-yl)propanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-(benzimidazol-1-yl)propanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-(benzimidazol-1-yl)propanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[3-(1-benzimidazolyl)-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-(benzimidazol-1-yl)propanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(benzimidazol-1-yl)propanoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCN2C=NC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCN2C=NC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C20H19N3O5/c1-27-19(25)13-9-14(20(26)28-2)11-15(10-13)22-18(24)7-8-23-12-21-16-5-3-4-6-17(16)23/h3-6,9-12H,7-8H2,1-2H3,(H,22,24)