dimethyl 2,5-bis[naphthalen-2-yl(phenyl)amino]cyclohexa-1,4-diene-1,4-dicarboxylate

Systemtic Name: dimethyl 2,5-bis[naphthalen-2-yl(phenyl)amino]cyclohexa-1,4-diene-1,4-dicarboxylate Openeye Name: dimethyl 2,5-bis[N-(2-naphthyl)anilino]cyclohexa-1,4-diene-1,4-dicarboxylate CAS Name: 2,5-bis[N-(2-naphthalenyl)anilino]cyclohexa-1,4-diene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,5-bis(N-naphthalen-2-ylanilino)cyclohexa-1,4-diene-1,4-dicarboxylate Traditional Name: 2,5-bis[N-(2-naphthyl)anilino]cyclohexa-1,4-diene-1,4-dicarboxylic acid dimethyl ester Formula: C42H34N2O4 MolecularWeight: 630.73036

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CC(=C(C1)N(C2=CC=CC=C2)C3=CC4=CC=CC=C4C=C3)C(=O)OC)N(C5=CC=CC=C5)C6=CC7=CC=CC=C7C=C6

Isomeric SMILES

COC(=O)C1=C(CC(=C(C1)N(C2=CC=CC=C2)C3=CC4=CC=CC=C4C=C3)C(=O)OC)N(C5=CC=CC=C5)C6=CC7=CC=CC=C7C=C6

InChI

InChI=1S/C42H34N2O4/c1-47-41(45)37-27-40(44(34-19-7-4-8-20-34)36-24-22-30-14-10-12-16-32(30)26-36)38(42(46)48-2)28-39(37)43(33-17-5-3-6-18-33)35-23-21-29-13-9-11-15-31(29)25-35/h3-26H,27-28H2,1-2H3