N,N'-bis(3-methoxy-6-nitro-acridin-9-yl)octane-1,8-diamine

Systemtic Name: N,N'-bis(3-methoxy-6-nitro-acridin-9-yl)octane-1,8-diamine Openeye Name: N,N'-bis(3-methoxy-6-nitro-acridin-9-yl)octane-1,8-diamine CAS Name: N,N'-bis(3-methoxy-6-nitro-9-acridinyl)octane-1,8-diamine IUPAC Name: N,N'-bis(3-methoxy-6-nitroacridin-9-yl)octane-1,8-diamine Traditional Name: (3-methoxy-6-nitro-acridin-9-yl)-[8-[(3-methoxy-6-nitro-acridin-9-yl)amino]octyl]amine Formula: C36H36N6O6 MolecularWeight: 648.70764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=C2C=C1)NCCCCCCCCNC4=C5C=CC(=CC5=NC6=C4C=CC(=C6)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC2=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=C2C=C1)NCCCCCCCCNC4=C5C=CC(=CC5=NC6=C4C=CC(=C6)[N+](=O)[O-])OC

InChI

InChI=1S/C36H36N6O6/c1-47-25-11-15-29-33(21-25)39-31-19-23(41(43)44)9-13-27(31)35(29)37-17-7-5-3-4-6-8-18-38-36-28-14-10-24(42(45)46)20-32(28)40-34-22-26(48-2)12-16-30(34)36/h9-16,19-22H,3-8,17-18H2,1-2H3,(H,37,39)(H,38,40)