methyl 2-[[1-(1H-benzimidazol-2-yl)piperidin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[1-(1H-benzimidazol-2-yl)piperidin-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[1-(1H-benzimidazol-2-yl)piperidine-3-carbonyl]amino]benzoate CAS Name: 2-[[[1-(1H-benzimidazol-2-yl)-3-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[1-(1H-benzimidazol-2-yl)piperidine-3-carbonyl]amino]benzoate Traditional Name: 2-[[1-(1H-benzimidazol-2-yl)nipecotoyl]amino]benzoic acid methyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2CCCN(C2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2CCCN(C2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H22N4O3/c1-28-20(27)15-8-2-3-9-16(15)22-19(26)14-7-6-12-25(13-14)21-23-17-10-4-5-11-18(17)24-21/h2-5,8-11,14H,6-7,12-13H2,1H3,(H,22,26)(H,23,24)