methyl 2-[4-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[[4-methoxy-3-(1-piperidylsulfonyl)phenyl]carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[4-methoxy-3-(1-piperidinylsulfonyl)anilino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(4-methoxy-3-piperidin-1-ylsulfonylphenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[(4-methoxy-3-piperidinosulfonyl-phenyl)carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C26H33N3O8S2 MolecularWeight: 579.68552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C26H33N3O8S2/c1-36-22-11-10-20(18-24(22)39(34,35)28-14-6-3-7-15-28)27-25(30)19-12-16-29(17-13-19)38(32,33)23-9-5-4-8-21(23)26(31)37-2/h4-5,8-11,18-19H,3,6-7,12-17H2,1-2H3,(H,27,30)