butyl 4-[(1-thiophen-2-ylcarbonylpiperidin-3-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(1-thiophen-2-ylcarbonylpiperidin-3-yl)carbonylamino]benzoate Openeye Name: butyl 4-[[1-(thiophene-2-carbonyl)piperidine-3-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[1-[oxo(thiophen-2-yl)methyl]-3-piperidinyl]methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-(thiophene-2-carbonyl)piperidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-(2-thenoyl)nipecotoyl]amino]benzoic acid butyl ester Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3

InChI

InChI=1S/C22H26N2O4S/c1-2-3-13-28-22(27)16-8-10-18(11-9-16)23-20(25)17-6-4-12-24(15-17)21(26)19-7-5-14-29-19/h5,7-11,14,17H,2-4,6,12-13,15H2,1H3,(H,23,25)