ethyl 4-[4-[(2-piperidin-1-ylphenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[(2-piperidin-1-ylphenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-[[2-(1-piperidyl)phenyl]carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[oxo-[2-(1-piperidinyl)anilino]methyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2-piperidin-1-ylphenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[(2-piperidinophenyl)carbamoyl]piperidino]sulfonylbenzoic acid ethyl ester Formula: C26H33N3O5S MolecularWeight: 499.62232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3N4CCCCC4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3N4CCCCC4

InChI

InChI=1S/C26H33N3O5S/c1-2-34-26(31)21-10-12-22(13-11-21)35(32,33)29-18-14-20(15-19-29)25(30)27-23-8-4-5-9-24(23)28-16-6-3-7-17-28/h4-5,8-13,20H,2-3,6-7,14-19H2,1H3,(H,27,30)