dimethyl-[[(1R,2S)-2-[(2-pentoxyphenyl)carbamoyloxy]cyclohexyl]methyl]azanium

Systemtic Name: dimethyl-[[(1R,2S)-2-[(2-pentoxyphenyl)carbamoyloxy]cyclohexyl]methyl]azanium Openeye Name: dimethyl-[[(1R,2S)-2-[(2-pentoxyphenyl)carbamoyloxy]cyclohexyl]methyl]ammonium CAS Name: dimethyl-[[(1R,2S)-2-[oxo-(2-pentoxyanilino)methoxy]cyclohexyl]methyl]ammonium IUPAC Name: dimethyl-[[(1R,2S)-2-[(2-pentoxyphenyl)carbamoyloxy]cyclohexyl]methyl]azanium Traditional Name: [(1R,2S)-2-[(2-amoxyphenyl)carbamoyloxy]cyclohexyl]methyl-dimethyl-ammonium Formula: C21H35N2O3+ MolecularWeight: 363.5142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1NC(=O)OC2CCCCC2C[NH+](C)C

Isomeric SMILES

CCCCCOC1=CC=CC=C1NC(=O)O[C@H]2CCCC[C@@H]2C[NH+](C)C

InChI

InChI=1S/C21H34N2O3/c1-4-5-10-15-25-20-14-9-7-12-18(20)22-21(24)26-19-13-8-6-11-17(19)16-23(2)3/h7,9,12,14,17,19H,4-6,8,10-11,13,15-16H2,1-3H3,(H,22,24)/p+1/t17-,19+/m1/s1