dimethyl-[[1-[(2R)-2-(4-nitrophenyl)carbonyloxy-2-phenyl-ethyl]cyclohexyl]methyl]azanium

Systemtic Name: dimethyl-[[1-[(2R)-2-(4-nitrophenyl)carbonyloxy-2-phenyl-ethyl]cyclohexyl]methyl]azanium Openeye Name: dimethyl-[[1-[(2R)-2-(4-nitrobenzoyl)oxy-2-phenyl-ethyl]cyclohexyl]methyl]ammonium CAS Name: dimethyl-[[1-[(2R)-2-[(4-nitrophenyl)-oxomethoxy]-2-phenylethyl]cyclohexyl]methyl]ammonium IUPAC Name: dimethyl-[[1-[(2R)-2-(4-nitrobenzoyl)oxy-2-phenylethyl]cyclohexyl]methyl]azanium Traditional Name: dimethyl-[[1-[(2R)-2-(4-nitrobenzoyl)oxy-2-phenyl-ethyl]cyclohexyl]methyl]ammonium Formula: C24H31N2O4+ MolecularWeight: 411.51394

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1(CCCCC1)CC(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CC1(CCCCC1)C[C@H](C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H30N2O4/c1-25(2)18-24(15-7-4-8-16-24)17-22(19-9-5-3-6-10-19)30-23(27)20-11-13-21(14-12-20)26(28)29/h3,5-6,9-14,22H,4,7-8,15-18H2,1-2H3/p+1/t22-/m1/s1