2-(3,4-dimethylphenyl)-4-[(pyridin-4-ylmethylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(3,4-dimethylphenyl)-4-[(pyridin-4-ylmethylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 2-(3,4-dimethylphenyl)-4-[(4-pyridylmethylamino)methylene]isoquinoline-1,3-dione CAS Name: 2-(3,4-dimethylphenyl)-4-[(pyridin-4-ylmethylamino)methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(3,4-dimethylphenyl)-4-[(pyridin-4-ylmethylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(3,4-dimethylphenyl)-4-[(4-pyridylmethylamino)methylene]isoquinoline-1,3-quinone Formula: C24H21N3O2 MolecularWeight: 383.44244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N3O2/c1-16-7-8-19(13-17(16)2)27-23(28)21-6-4-3-5-20(21)22(24(27)29)15-26-14-18-9-11-25-12-10-18/h3-13,15,26H,14H2,1-2H3