6-(3-azanylpropylamino)-2-(2,3-dimethoxyphenyl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-(3-azanylpropylamino)-2-(2,3-dimethoxyphenyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 6-(3-aminopropylamino)-2-(2,3-dimethoxyphenyl)benzo[de]isoquinoline-1,3-dione CAS Name: 6-(3-aminopropylamino)-2-(2,3-dimethoxyphenyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-(3-aminopropylamino)-2-(2,3-dimethoxyphenyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-(3-aminopropylamino)-2-(2,3-dimethoxyphenyl)benzo[de]isoquinoline-1,3-quinone Formula: C23H23N3O4 MolecularWeight: 405.44642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)N2C(=O)C3=C4C(=C(C=C3)NCCCN)C=CC=C4C2=O

Isomeric SMILES

COC1=CC=CC(=C1OC)N2C(=O)C3=C4C(=C(C=C3)NCCCN)C=CC=C4C2=O

InChI

InChI=1S/C23H23N3O4/c1-29-19-9-4-8-18(21(19)30-2)26-22(27)15-7-3-6-14-17(25-13-5-12-24)11-10-16(20(14)15)23(26)28/h3-4,6-11,25H,5,12-13,24H2,1-2H3