N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3-methyl-butan-1-amine

Systemtic Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3-methyl-butan-1-amine Openeye Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3-methyl-butan-1-amine CAS Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-3-methyl-1-butanamine IUPAC Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-3-methylbutan-1-amine Traditional Name: [4-(aminomethyl)cyclohexyl]methyl-(4,5-dimethoxy-2-nitro-benzyl)-isoamyl-amine Formula: C22H37N3O4 MolecularWeight: 407.54688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC1CCC(CC1)CN)CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CC(C)CCN(CC1CCC(CC1)CN)CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C22H37N3O4/c1-16(2)9-10-24(14-18-7-5-17(13-23)6-8-18)15-19-11-21(28-3)22(29-4)12-20(19)25(26)27/h11-12,16-18H,5-10,13-15,23H2,1-4H3