6-(octylamino)-2-(3-oxidanylpropyl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-(octylamino)-2-(3-oxidanylpropyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(3-hydroxypropyl)-6-(octylamino)benzo[de]isoquinoline-1,3-dione CAS Name: 2-(3-hydroxypropyl)-6-(octylamino)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(3-hydroxypropyl)-6-(octylamino)benzo[de]isoquinoline-1,3-dione Traditional Name: 2-(3-hydroxypropyl)-6-(octylamino)benzo[de]isoquinoline-1,3-quinone Formula: C23H30N2O3 MolecularWeight: 382.4959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)CCCO

Isomeric SMILES

CCCCCCCCNC1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)CCCO

InChI

InChI=1S/C23H30N2O3/c1-2-3-4-5-6-7-14-24-20-13-12-19-21-17(20)10-8-11-18(21)22(27)25(23(19)28)15-9-16-26/h8,10-13,24,26H,2-7,9,14-16H2,1H3