N3-[4-[(4-azanyl-3-methyl-cyclohexyl)methyl]-2-methyl-cyclohexyl]-N1-cyclooctyl-4,6-dinitro-benzene-1,3-diamine

Systemtic Name: N3-[4-[(4-azanyl-3-methyl-cyclohexyl)methyl]-2-methyl-cyclohexyl]-N1-cyclooctyl-4,6-dinitro-benzene-1,3-diamine Openeye Name: N3-[4-[(4-amino-3-methyl-cyclohexyl)methyl]-2-methyl-cyclohexyl]-N1-cyclooctyl-4,6-dinitro-benzene-1,3-diamine CAS Name: N3-[4-[(4-amino-3-methylcyclohexyl)methyl]-2-methylcyclohexyl]-N1-cyclooctyl-4,6-dinitrobenzene-1,3-diamine IUPAC Name: 3-N-[4-[(4-amino-3-methylcyclohexyl)methyl]-2-methylcyclohexyl]-1-N-cyclooctyl-4,6-dinitrobenzene-1,3-diamine Traditional Name: [4-[(4-amino-3-methyl-cyclohexyl)methyl]-2-methyl-cyclohexyl]-[5-(cyclooctylamino)-2,4-dinitro-phenyl]amine Formula: C29H47N5O4 MolecularWeight: 529.71458

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCC1N)CC2CCC(C(C2)C)NC3=C(C=C(C(=C3)NC4CCCCCCC4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1CC(CCC1N)CC2CCC(C(C2)C)NC3=C(C=C(C(=C3)NC4CCCCCCC4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C29H47N5O4/c1-19-14-21(10-12-24(19)30)16-22-11-13-25(20(2)15-22)32-27-17-26(28(33(35)36)18-29(27)34(37)38)31-23-8-6-4-3-5-7-9-23/h17-25,31-32H,3-16,30H2,1-2H3