4-(4-butoxyphenyl)-N-methyl-cyclohexan-1-amine nitrate

Systemtic Name: 4-(4-butoxyphenyl)-N-methyl-cyclohexan-1-amine nitrate Openeye Name: 4-(4-butoxyphenyl)-N-methyl-cyclohexanamine nitrate CAS Name: 4-(4-butoxyphenyl)-N-methyl-1-cyclohexanamine nitrate IUPAC Name: 4-(4-butoxyphenyl)-N-methylcyclohexan-1-amine nitrate Traditional Name: [4-(4-butoxyphenyl)cyclohexyl]-methyl-amine nitrate Formula: C17H27N2O4- MolecularWeight: 323.40728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2CCC(CC2)NC.[N+](=O)([O-])[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2CCC(CC2)NC.[N+](=O)([O-])[O-]

InChI

InChI=1S/C17H27NO.NO3/c1-3-4-13-19-17-11-7-15(8-12-17)14-5-9-16(18-2)10-6-14;2-1(3)4/h7-8,11-12,14,16,18H,3-6,9-10,13H2,1-2H3;/q;-1