dimethyl 5-[2-(5,6-dimethylbenzimidazol-1-yl)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(5,6-dimethylbenzimidazol-1-yl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(5,6-dimethylbenzimidazol-1-yl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(5,6-dimethyl-1-benzimidazolyl)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(5,6-dimethylbenzimidazol-1-yl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(5,6-dimethylbenzimidazol-1-yl)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)CC(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)CC(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H21N3O5/c1-12-5-17-18(6-13(12)2)24(11-22-17)10-19(25)23-16-8-14(20(26)28-3)7-15(9-16)21(27)29-4/h5-9,11H,10H2,1-4H3,(H,23,25)