3-(4-methylpiperazin-1-yl)-8-octyl-indolo[2,1-b]quinazoline-6,12-dione

Systemtic Name: 3-(4-methylpiperazin-1-yl)-8-octyl-indolo[2,1-b]quinazoline-6,12-dione Openeye Name: 3-(4-methylpiperazin-1-yl)-8-octyl-indolo[2,1-b]quinazoline-6,12-dione CAS Name: 3-(4-methyl-1-piperazinyl)-8-octylindolo[2,1-b]quinazoline-6,12-dione IUPAC Name: 3-(4-methylpiperazin-1-yl)-8-octylindolo[2,1-b]quinazoline-6,12-dione Traditional Name: 3-(4-methylpiperazino)-8-octyl-indolo[2,1-b]quinazoline-6,12-quinone Formula: C28H34N4O2 MolecularWeight: 458.59516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC2=C(C=C1)N3C(=NC4=C(C3=O)C=CC(=C4)N5CCN(CC5)C)C2=O

Isomeric SMILES

CCCCCCCCC1=CC2=C(C=C1)N3C(=NC4=C(C3=O)C=CC(=C4)N5CCN(CC5)C)C2=O

InChI

InChI=1S/C28H34N4O2/c1-3-4-5-6-7-8-9-20-10-13-25-23(18-20)26(33)27-29-24-19-21(31-16-14-30(2)15-17-31)11-12-22(24)28(34)32(25)27/h10-13,18-19H,3-9,14-17H2,1-2H3