3-[(4-hydroxyphenyl)methyl]-5-(3-nitrophenyl)-4,6-bis(oxidanylidene)-1-thiophen-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-[(4-hydroxyphenyl)methyl]-5-(3-nitrophenyl)-4,6-bis(oxidanylidene)-1-thiophen-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 3-[(4-hydroxyphenyl)methyl]-5-(3-nitrophenyl)-4,6-dioxo-1-(2-thienyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 3-[(4-hydroxyphenyl)methyl]-5-(3-nitrophenyl)-4,6-dioxo-1-thiophen-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 3-[(4-hydroxyphenyl)methyl]-5-(3-nitrophenyl)-4,6-dioxo-1-thiophen-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 3-(4-hydroxybenzyl)-4,6-diketo-5-(3-nitrophenyl)-1-(2-thienyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C24H19N3O7S MolecularWeight: 493.48856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C3C(C2=O)C(NC3C4=CC=CS4)(CC5=CC=C(C=C5)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C3C(C2=O)C(NC3C4=CC=CS4)(CC5=CC=C(C=C5)O)C(=O)O

InChI

InChI=1S/C24H19N3O7S/c28-16-8-6-13(7-9-16)12-24(23(31)32)19-18(20(25-24)17-5-2-10-35-17)21(29)26(22(19)30)14-3-1-4-15(11-14)27(33)34/h1-11,18-20,25,28H,12H2,(H,31,32)