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

Systemtic Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3-phenyl-prop-2-en-1-amine Openeye Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3-phenyl-prop-2-en-1-amine CAS Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-3-phenyl-2-propen-1-amine IUPAC Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-3-phenylprop-2-en-1-amine Traditional Name: [4-(aminomethyl)cyclohexyl]methyl-cinnamyl-(4,5-dimethoxy-2-nitro-benzyl)amine Formula: C26H35N3O4 MolecularWeight: 453.5738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CN(CC=CC2=CC=CC=C2)CC3CCC(CC3)CN)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CN(CC=CC2=CC=CC=C2)CC3CCC(CC3)CN)[N+](=O)[O-])OC

InChI

InChI=1S/C26H35N3O4/c1-32-25-15-23(24(29(30)31)16-26(25)33-2)19-28(14-6-9-20-7-4-3-5-8-20)18-22-12-10-21(17-27)11-13-22/h3-9,15-16,21-22H,10-14,17-19,27H2,1-2H3