butyl 4-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(1-methylsulfonylpiperidine-4-carbonyl)amino]benzoate CAS Name: 4-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(1-methylsulfonylpiperidine-4-carbonyl)amino]benzoate Traditional Name: 4-[(1-mesylisonipecotoyl)amino]benzoic acid butyl ester Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C18H26N2O5S/c1-3-4-13-25-18(22)15-5-7-16(8-6-15)19-17(21)14-9-11-20(12-10-14)26(2,23)24/h5-8,14H,3-4,9-13H2,1-2H3,(H,19,21)