methyl 4-[[2-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(2-oxo-3-propyl-benzimidazol-1-yl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[1-oxo-2-(2-oxo-3-propyl-1-benzimidazolyl)ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(2-keto-3-propyl-benzimidazol-1-yl)acetyl]amino]methyl]benzoic acid methyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H23N3O4/c1-3-12-23-17-6-4-5-7-18(17)24(21(23)27)14-19(25)22-13-15-8-10-16(11-9-15)20(26)28-2/h4-11H,3,12-14H2,1-2H3,(H,22,25)