ethyl 2-[[1,3-bis(oxidanylidene)-2-(4-phenylphenyl)isoquinolin-4-ylidene]methylamino]benzoate

Systemtic Name: ethyl 2-[[1,3-bis(oxidanylidene)-2-(4-phenylphenyl)isoquinolin-4-ylidene]methylamino]benzoate Openeye Name: ethyl 2-[[1,3-dioxo-2-(4-phenylphenyl)-4-isoquinolylidene]methylamino]benzoate CAS Name: 2-[[1,3-dioxo-2-(4-phenylphenyl)-4-isoquinolinylidene]methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[1,3-dioxo-2-(4-phenylphenyl)isoquinolin-4-ylidene]methylamino]benzoate Traditional Name: 2-[[1,3-diketo-2-(4-phenylphenyl)-4-isoquinolylidene]methylamino]benzoic acid ethyl ester Formula: C31H24N2O4 MolecularWeight: 488.53326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H24N2O4/c1-2-37-31(36)26-14-8-9-15-28(26)32-20-27-24-12-6-7-13-25(24)29(34)33(30(27)35)23-18-16-22(17-19-23)21-10-4-3-5-11-21/h3-20,32H,2H2,1H3