methyl 2-[2-(2-methylphenyl)-3-(4-nitrophenyl)-4,6-bis(oxidanylidene)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(2-methylphenyl)-3-(4-nitrophenyl)-4,6-bis(oxidanylidene)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[3-(4-nitrophenyl)-2-(o-tolyl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazol-5-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[2-(2-methylphenyl)-3-(4-nitrophenyl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(2-methylphenyl)-3-(4-nitrophenyl)-4,6-dioxo-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[4,6-diketo-3-(4-nitrophenyl)-2-(o-tolyl)-3a,6a-dihydro-3H-pyrrol[3,4-d]isoxazol-5-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C28H25N3O7S MolecularWeight: 547.579

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(C3C(O2)C(=O)N(C3=O)C4=C(C5=C(S4)CCCC5)C(=O)OC)C6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(C3C(O2)C(=O)N(C3=O)C4=C(C5=C(S4)CCCC5)C(=O)OC)C6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C28H25N3O7S/c1-15-7-3-5-9-19(15)30-23(16-11-13-17(14-12-16)31(35)36)22-24(38-30)26(33)29(25(22)32)27-21(28(34)37-2)18-8-4-6-10-20(18)39-27/h3,5,7,9,11-14,22-24H,4,6,8,10H2,1-2H3