diethyl 2-[3-ethoxycarbonyl-1-(4-methylphenyl)-4-[(4-methylphenyl)amino]-5-oxidanylidene-pyrrol-2-ylidene]propanedioate

Systemtic Name: diethyl 2-[3-ethoxycarbonyl-1-(4-methylphenyl)-4-[(4-methylphenyl)amino]-5-oxidanylidene-pyrrol-2-ylidene]propanedioate Openeye Name: diethyl 2-[3-ethoxycarbonyl-4-(4-methylanilino)-5-oxo-1-(p-tolyl)pyrrol-2-ylidene]propanedioate CAS Name: 2-[3-ethoxycarbonyl-4-(4-methylanilino)-1-(4-methylphenyl)-5-oxo-2-pyrrolylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[3-ethoxycarbonyl-4-(4-methylanilino)-1-(4-methylphenyl)-5-oxopyrrol-2-ylidene]propanedioate Traditional Name: 2-[3-carbethoxy-5-keto-4-(p-toluidino)-1-(p-tolyl)-3-pyrrolin-2-ylidene]malonic acid diethyl ester Formula: C28H30N2O7 MolecularWeight: 506.547

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(C1=C(C(=O)OCC)C(=O)OCC)C2=CC=C(C=C2)C)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(C1=C(C(=O)OCC)C(=O)OCC)C2=CC=C(C=C2)C)NC3=CC=C(C=C3)C

InChI

InChI=1S/C28H30N2O7/c1-6-35-26(32)21-23(29-19-13-9-17(4)10-14-19)25(31)30(20-15-11-18(5)12-16-20)24(21)22(27(33)36-7-2)28(34)37-8-3/h9-16,29H,6-8H2,1-5H3