2-[2-[(R)-cyclohexyl-oxidanyl-phenyl-methyl]-1,3-oxazol-5-yl]ethyl-dimethyl-[(4-methylphenyl)methoxycarbonyl]azanium

Systemtic Name: 2-[2-[(R)-cyclohexyl-oxidanyl-phenyl-methyl]-1,3-oxazol-5-yl]ethyl-dimethyl-[(4-methylphenyl)methoxycarbonyl]azanium Openeye Name: 2-[2-[(R)-cyclohexyl-hydroxy-phenyl-methyl]oxazol-5-yl]ethyl-dimethyl-(p-tolylmethoxycarbonyl)ammonium CAS Name: 2-[2-[(R)-cyclohexyl-hydroxy-phenylmethyl]-5-oxazolyl]ethyl-dimethyl-[(4-methylphenyl)methoxy-oxomethyl]ammonium IUPAC Name: 2-[2-[(R)-cyclohexyl-hydroxy-phenylmethyl]-1,3-oxazol-5-yl]ethyl-dimethyl-[(4-methylphenyl)methoxycarbonyl]azanium Traditional Name: 2-[2-[(R)-cyclohexyl-hydroxy-phenyl-methyl]oxazol-5-yl]ethyl-dimethyl-(4-methylbenzyl)oxycarbonyl-ammonium Formula: C29H37N2O4+ MolecularWeight: 477.61508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)[N+](C)(C)CCC2=CN=C(O2)C(C3CCCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)[N+](C)(C)CCC2=CN=C(O2)[C@@](C3CCCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C29H37N2O4/c1-22-14-16-23(17-15-22)21-34-28(32)31(2,3)19-18-26-20-30-27(35-26)29(33,24-10-6-4-7-11-24)25-12-8-5-9-13-25/h4,6-7,10-11,14-17,20,25,33H,5,8-9,12-13,18-19,21H2,1-3H3/q+1/t29-/m0/s1