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

Systemtic Name: 6-[2-(4-methylpiperazin-1-yl)ethylamino]-2-octyl-benzo[de]isoquinoline-1,3-dione Openeye Name: 6-[2-(4-methylpiperazin-1-yl)ethylamino]-2-octyl-benzo[de]isoquinoline-1,3-dione CAS Name: 6-[2-(4-methyl-1-piperazinyl)ethylamino]-2-octylbenzo[de]isoquinoline-1,3-dione IUPAC Name: 6-[2-(4-methylpiperazin-1-yl)ethylamino]-2-octylbenzo[de]isoquinoline-1,3-dione Traditional Name: 6-[2-(4-methylpiperazino)ethylamino]-2-octyl-benzo[de]isoquinoline-1,3-quinone Formula: C27H38N4O2 MolecularWeight: 450.61622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=O)C2=C3C(=C(C=C2)NCCN4CCN(CC4)C)C=CC=C3C1=O

Isomeric SMILES

CCCCCCCCN1C(=O)C2=C3C(=C(C=C2)NCCN4CCN(CC4)C)C=CC=C3C1=O

InChI

InChI=1S/C27H38N4O2/c1-3-4-5-6-7-8-15-31-26(32)22-11-9-10-21-24(13-12-23(25(21)22)27(31)33)28-14-16-30-19-17-29(2)18-20-30/h9-13,28H,3-8,14-20H2,1-2H3