diethyl 2-azanyl-4,6-bis(4-chlorophenyl)-3-cyano-4-methyl-cyclohexa-1,5-diene-1,3-dicarboxylate

Systemtic Name: diethyl 2-azanyl-4,6-bis(4-chlorophenyl)-3-cyano-4-methyl-cyclohexa-1,5-diene-1,3-dicarboxylate Openeye Name: diethyl 2-amino-4,6-bis(4-chlorophenyl)-3-cyano-4-methyl-cyclohexa-1,5-diene-1,3-dicarboxylate CAS Name: 2-amino-4,6-bis(4-chlorophenyl)-3-cyano-4-methylcyclohexa-1,5-diene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-amino-4,6-bis(4-chlorophenyl)-3-cyano-4-methylcyclohexa-1,5-diene-1,3-dicarboxylate Traditional Name: 2-amino-4,6-bis(4-chlorophenyl)-3-cyano-4-methyl-cyclohexa-1,5-diene-1,3-dicarboxylic acid diethyl ester Formula: C26H24Cl2N2O4 MolecularWeight: 499.38576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(C(C=C1C2=CC=C(C=C2)Cl)(C)C3=CC=C(C=C3)Cl)(C#N)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(C(C(C=C1C2=CC=C(C=C2)Cl)(C)C3=CC=C(C=C3)Cl)(C#N)C(=O)OCC)N

InChI

InChI=1S/C26H24Cl2N2O4/c1-4-33-23(31)21-20(16-6-10-18(27)11-7-16)14-25(3,17-8-12-19(28)13-9-17)26(15-29,22(21)30)24(32)34-5-2/h6-14H,4-5,30H2,1-3H3