ethyl 4-[4-[(4-methylphenyl)methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)C

InChI

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