2-dodecyl-6-[2-(4-methylpiperazin-1-yl)ethylamino]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-dodecyl-6-[2-(4-methylpiperazin-1-yl)ethylamino]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-dodecyl-6-[2-(4-methylpiperazin-1-yl)ethylamino]benzo[de]isoquinoline-1,3-dione CAS Name: 2-dodecyl-6-[2-(4-methyl-1-piperazinyl)ethylamino]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-dodecyl-6-[2-(4-methylpiperazin-1-yl)ethylamino]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-lauryl-6-[2-(4-methylpiperazino)ethylamino]benzo[de]isoquinoline-1,3-quinone Formula: C31H46N4O2 MolecularWeight: 506.72254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C(=O)C2=C3C(=C(C=C2)NCCN4CCN(CC4)C)C=CC=C3C1=O

Isomeric SMILES

CCCCCCCCCCCCN1C(=O)C2=C3C(=C(C=C2)NCCN4CCN(CC4)C)C=CC=C3C1=O

InChI

InChI=1S/C31H46N4O2/c1-3-4-5-6-7-8-9-10-11-12-19-35-30(36)26-15-13-14-25-28(17-16-27(29(25)26)31(35)37)32-18-20-34-23-21-33(2)22-24-34/h13-17,32H,3-12,18-24H2,1-2H3