N12-[4-(4-methylpiperazin-1-yl)butyl]-N6-(4-piperidin-1-ylbutyl)chrysene-6,12-diamine

Systemtic Name: N12-[4-(4-methylpiperazin-1-yl)butyl]-N6-(4-piperidin-1-ylbutyl)chrysene-6,12-diamine Openeye Name: N12-[4-(4-methylpiperazin-1-yl)butyl]-N6-[4-(1-piperidyl)butyl]chrysene-6,12-diamine CAS Name: N12-[4-(4-methyl-1-piperazinyl)butyl]-N6-[4-(1-piperidinyl)butyl]chrysene-6,12-diamine IUPAC Name: 12-N-[4-(4-methylpiperazin-1-yl)butyl]-6-N-(4-piperidin-1-ylbutyl)chrysene-6,12-diamine Traditional Name: 4-(4-methylpiperazino)butyl-[12-(4-piperidinobutylamino)chrysen-6-yl]amine Formula: C36H49N5 MolecularWeight: 551.80776

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCCNC2=CC3=C(C=C(C4=CC=CC=C43)NCCCCN5CCCCC5)C6=CC=CC=C62

Isomeric SMILES

CN1CCN(CC1)CCCCNC2=CC3=C(C=C(C4=CC=CC=C43)NCCCCN5CCCCC5)C6=CC=CC=C62

InChI

InChI=1S/C36H49N5/c1-39-23-25-41(26-24-39)22-12-8-18-38-36-28-34-29-13-3-5-15-31(29)35(27-33(34)30-14-4-6-16-32(30)36)37-17-7-11-21-40-19-9-2-10-20-40/h3-6,13-16,27-28,37-38H,2,7-12,17-26H2,1H3