ethyl 4-[4-[(3-chlorophenyl)methyl-methyl-carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[(3-chlorophenyl)methyl-methyl-carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-[(3-chlorophenyl)methyl-methyl-carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[[(3-chlorophenyl)methyl-methylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-chlorophenyl)methyl-methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[(3-chlorobenzyl)-methyl-carbamoyl]piperidino]sulfonylbenzoic acid ethyl ester Formula: C23H27ClN2O5S MolecularWeight: 478.98888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H27ClN2O5S/c1-3-31-23(28)19-7-9-21(10-8-19)32(29,30)26-13-11-18(12-14-26)22(27)25(2)16-17-5-4-6-20(24)15-17/h4-10,15,18H,3,11-14,16H2,1-2H3