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

Systemtic Name: 2-[[2-(3,4-dimethylphenyl)-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methylamino]benzoate Openeye Name: 2-[[2-(3,4-dimethylphenyl)-1,3-dioxo-4-isoquinolylidene]methylamino]benzoate CAS Name: 2-[[2-(3,4-dimethylphenyl)-1,3-dioxo-4-isoquinolinylidene]methylamino]benzoate IUPAC Name: 2-[[2-(3,4-dimethylphenyl)-1,3-dioxoisoquinolin-4-ylidene]methylamino]benzoate Traditional Name: 2-[[2-(3,4-dimethylphenyl)-1,3-diketo-4-isoquinolylidene]methylamino]benzoate Formula: C25H19N2O4- MolecularWeight: 411.42936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC=CC=C4C(=O)[O-])C2=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC=CC=C4C(=O)[O-])C2=O)C

InChI

InChI=1S/C25H20N2O4/c1-15-11-12-17(13-16(15)2)27-23(28)19-8-4-3-7-18(19)21(24(27)29)14-26-22-10-6-5-9-20(22)25(30)31/h3-14,26H,1-2H3,(H,30,31)/p-1