[[3-[(4-methylphenyl)sulfonylcarbamoyl]-2-morpholin-4-yl-cyclopent-2-en-1-ylidene]-phenyl-methyl] benzoate

Systemtic Name: [[3-[(4-methylphenyl)sulfonylcarbamoyl]-2-morpholin-4-yl-cyclopent-2-en-1-ylidene]-phenyl-methyl] benzoate Openeye Name: [[2-morpholino-3-(p-tolylsulfonylcarbamoyl)cyclopent-2-en-1-ylidene]-phenyl-methyl] benzoate CAS Name: benzoic acid [[3-[[(4-methylphenyl)sulfonylamino]-oxomethyl]-2-(4-morpholinyl)-1-cyclopent-2-enylidene]-phenylmethyl] ester IUPAC Name: [[3-[(4-methylphenyl)sulfonylcarbamoyl]-2-morpholin-4-ylcyclopent-2-en-1-ylidene]-phenylmethyl] benzoate Traditional Name: benzoic acid [[2-morpholino-3-(tosylcarbamoyl)cyclopent-2-en-1-ylidene]-phenyl-methyl] ester Formula: C31H30N2O6S MolecularWeight: 558.6447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=C(C(=C(C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)CC2)N5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=C(C(=C(C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)CC2)N5CCOCC5

InChI

InChI=1S/C31H30N2O6S/c1-22-12-14-25(15-13-22)40(36,37)32-30(34)27-17-16-26(28(27)33-18-20-38-21-19-33)29(23-8-4-2-5-9-23)39-31(35)24-10-6-3-7-11-24/h2-15H,16-21H2,1H3,(H,32,34)