methyl 2-[4-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[[4-(2-oxopyrrolidin-1-yl)phenyl]methylcarbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[oxo-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methylamino]methyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[4-(2-oxopyrrolidin-1-yl)phenyl]methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[[4-(2-ketopyrrolidino)benzyl]carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C25H29N3O6S MolecularWeight: 499.57926

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C25H29N3O6S/c1-34-25(31)21-5-2-3-6-22(21)35(32,33)27-15-12-19(13-16-27)24(30)26-17-18-8-10-20(11-9-18)28-14-4-7-23(28)29/h2-3,5-6,8-11,19H,4,7,12-17H2,1H3,(H,26,30)