2-(3,4-dimethylphenyl)-4-[[(phenylmethyl)amino]methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(3,4-dimethylphenyl)-4-[[(phenylmethyl)amino]methylidene]isoquinoline-1,3-dione Openeye Name: 4-[(benzylamino)methylene]-2-(3,4-dimethylphenyl)isoquinoline-1,3-dione CAS Name: 2-(3,4-dimethylphenyl)-4-[[(phenylmethyl)amino]methylidene]isoquinoline-1,3-dione IUPAC Name: 4-[(benzylamino)methylidene]-2-(3,4-dimethylphenyl)isoquinoline-1,3-dione Traditional Name: 4-[(benzylamino)methylene]-2-(3,4-dimethylphenyl)isoquinoline-1,3-quinone Formula: C25H22N2O2 MolecularWeight: 382.45438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNCC4=CC=CC=C4)C2=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNCC4=CC=CC=C4)C2=O)C

InChI

InChI=1S/C25H22N2O2/c1-17-12-13-20(14-18(17)2)27-24(28)22-11-7-6-10-21(22)23(25(27)29)16-26-15-19-8-4-3-5-9-19/h3-14,16,26H,15H2,1-2H3