ethyl 2-methyl-3-[[1-(phenylmethyl)sulfonylpiperidin-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 2-methyl-3-[[1-(phenylmethyl)sulfonylpiperidin-4-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[(1-benzylsulfonylpiperidine-4-carbonyl)amino]-2-methyl-benzoate CAS Name: 2-methyl-3-[[oxo-[1-(phenylmethyl)sulfonyl-4-piperidinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(1-benzylsulfonylpiperidine-4-carbonyl)amino]-2-methylbenzoate Traditional Name: 3-[(1-benzylsulfonylisonipecotoyl)amino]-2-methyl-benzoic acid ethyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H28N2O5S/c1-3-30-23(27)20-10-7-11-21(17(20)2)24-22(26)19-12-14-25(15-13-19)31(28,29)16-18-8-5-4-6-9-18/h4-11,19H,3,12-16H2,1-2H3,(H,24,26)