N8-[(4-methoxyphenyl)methyl]-N8-methyl-2-nitro-3-[2-(pyridin-2-ylamino)ethyl]oct-1-ene-1,1,8-triamine

Systemtic Name: N8-[(4-methoxyphenyl)methyl]-N8-methyl-2-nitro-3-[2-(pyridin-2-ylamino)ethyl]oct-1-ene-1,1,8-triamine Openeye Name: N8-[(4-methoxyphenyl)methyl]-N8-methyl-2-nitro-3-[2-(2-pyridylamino)ethyl]oct-1-ene-1,1,8-triamine CAS Name: N8-[(4-methoxyphenyl)methyl]-N8-methyl-2-nitro-3-[2-(2-pyridinylamino)ethyl]-1-octene-1,1,8-triamine IUPAC Name: 8-N-[(4-methoxyphenyl)methyl]-8-N-methyl-2-nitro-3-[2-(pyridin-2-ylamino)ethyl]oct-1-ene-1,1,8-triamine Traditional Name: [8,8-diamino-7-nitro-6-[2-(2-pyridylamino)ethyl]oct-7-enyl]-methyl-p-anisyl-amine Formula: C24H36N6O3 MolecularWeight: 456.58104

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCCC(CCNC1=CC=CC=N1)C(=C(N)N)[N+](=O)[O-])CC2=CC=C(C=C2)OC

Isomeric SMILES

CN(CCCCCC(CCNC1=CC=CC=N1)C(=C(N)N)[N+](=O)[O-])CC2=CC=C(C=C2)OC

InChI

InChI=1S/C24H36N6O3/c1-29(18-19-10-12-21(33-2)13-11-19)17-7-3-4-8-20(23(24(25)26)30(31)32)14-16-28-22-9-5-6-15-27-22/h5-6,9-13,15,20H,3-4,7-8,14,16-18,25-26H2,1-2H3,(H,27,28)