methyl 2-[4-[methyl-[(4-methylphenyl)methyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[methyl-[(4-methylphenyl)methyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[methyl(p-tolylmethyl)carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[methyl-[(4-methylphenyl)methyl]amino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[methyl-[(4-methylphenyl)methyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[methyl-(4-methylbenzyl)carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

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