2-(2,4-dimethylphenyl)-6-piperazin-1-yl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(2,4-dimethylphenyl)-6-piperazin-1-yl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(2,4-dimethylphenyl)-6-piperazin-1-yl-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(2,4-dimethylphenyl)-6-(1-piperazinyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2,4-dimethylphenyl)-6-piperazin-1-ylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(2,4-dimethylphenyl)-6-piperazino-benzo[de]isoquinoline-1,3-quinone Formula: C24H23N3O2 MolecularWeight: 385.45832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C3=C4C(=C(C=C3)N5CCNCC5)C=CC=C4C2=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=C4C(=C(C=C3)N5CCNCC5)C=CC=C4C2=O)C

InChI

InChI=1S/C24H23N3O2/c1-15-6-8-20(16(2)14-15)27-23(28)18-5-3-4-17-21(26-12-10-25-11-13-26)9-7-19(22(17)18)24(27)29/h3-9,14,25H,10-13H2,1-2H3