methyl 4-[3-[(4-methoxyphenyl)sulfonyl-prop-2-enyl-amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: methyl 4-[3-[(4-methoxyphenyl)sulfonyl-prop-2-enyl-amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: methyl 4-[3-[allyl-(4-methoxyphenyl)sulfonyl-amino]-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-[(4-methoxyphenyl)sulfonyl-prop-2-enylamino]-2,5-dioxo-1-pyrrolidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[(4-methoxyphenyl)sulfonyl-prop-2-enylamino]-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[3-[allyl-(4-methoxyphenyl)sulfonyl-amino]-2,5-diketo-pyrrolidino]benzoic acid methyl ester Formula: C22H22N2O7S MolecularWeight: 458.48428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC=C)C2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC=C)C2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H22N2O7S/c1-4-13-23(32(28,29)18-11-9-17(30-2)10-12-18)19-14-20(25)24(21(19)26)16-7-5-15(6-8-16)22(27)31-3/h4-12,19H,1,13-14H2,2-3H3