[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl] 1-(3,4-dimethylphenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: [2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl] 1-(3,4-dimethylphenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: [2-(4-morpholinoanilino)-2-oxo-ethyl] 1-(3,4-dimethylphenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-4-hydroxy-2-pyrrolidinecarboxylic acid [2-[4-(4-morpholinyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-morpholin-4-ylanilino)-2-oxoethyl] 1-(3,4-dimethylphenyl)sulfonyl-4-hydroxypyrrolidine-2-carboxylate Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylic acid [2-keto-2-(4-morpholinoanilino)ethyl] ester Formula: C25H31N3O7S MolecularWeight: 517.59454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)OCC(=O)NC3=CC=C(C=C3)N4CCOCC4)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)OCC(=O)NC3=CC=C(C=C3)N4CCOCC4)O)C

InChI

InChI=1S/C25H31N3O7S/c1-17-3-8-22(13-18(17)2)36(32,33)28-15-21(29)14-23(28)25(31)35-16-24(30)26-19-4-6-20(7-5-19)27-9-11-34-12-10-27/h3-8,13,21,23,29H,9-12,14-16H2,1-2H3,(H,26,30)