2-[[4-(4-butoxyphenyl)cyclohexyl]methylamino]-1-(2-chlorophenyl)ethanone nitrate

Systemtic Name: 2-[[4-(4-butoxyphenyl)cyclohexyl]methylamino]-1-(2-chlorophenyl)ethanone nitrate Openeye Name: 2-[[4-(4-butoxyphenyl)cyclohexyl]methylamino]-1-(2-chlorophenyl)ethanone nitrate CAS Name: 2-[[4-(4-butoxyphenyl)cyclohexyl]methylamino]-1-(2-chlorophenyl)ethanone nitrate IUPAC Name: 2-[[4-(4-butoxyphenyl)cyclohexyl]methylamino]-1-(2-chlorophenyl)ethanone nitrate Traditional Name: 2-[[4-(4-butoxyphenyl)cyclohexyl]methylamino]-1-(2-chlorophenyl)ethanone nitrate Formula: C25H32ClN2O5- MolecularWeight: 475.98498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2CCC(CC2)CNCC(=O)C3=CC=CC=C3Cl.[N+](=O)([O-])[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2CCC(CC2)CNCC(=O)C3=CC=CC=C3Cl.[N+](=O)([O-])[O-]

InChI

InChI=1S/C25H32ClNO2.NO3/c1-2-3-16-29-22-14-12-21(13-15-22)20-10-8-19(9-11-20)17-27-18-25(28)23-6-4-5-7-24(23)26;2-1(3)4/h4-7,12-15,19-20,27H,2-3,8-11,16-18H2,1H3;/q;-1