4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-2-(3-methylphenyl)isoquinoline-1,3-dione

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-2-(3-methylphenyl)isoquinoline-1,3-dione Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylene)-2-(m-tolyl)isoquinoline-1,3-dione CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-2-(3-methylphenyl)isoquinoline-1,3-dione IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-2-(3-methylphenyl)isoquinoline-1,3-dione Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylene)-2-(m-tolyl)isoquinoline-1,3-quinone Formula: C25H19NO4 MolecularWeight: 397.42266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC5=C(C=C4)OCCO5)C2=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC5=C(C=C4)OCCO5)C2=O

InChI

InChI=1S/C25H19NO4/c1-16-5-4-6-18(13-16)26-24(27)20-8-3-2-7-19(20)21(25(26)28)14-17-9-10-22-23(15-17)30-12-11-29-22/h2-10,13-15H,11-12H2,1H3