(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-methylphenyl)-3-oxidanyl-propanoate

Systemtic Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-methylphenyl)-3-oxidanyl-propanoate Openeye Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-(p-tolyl)propanoate CAS Name: 3-hydroxy-2-(4-methylphenyl)propanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-(4-methylphenyl)propanoate Traditional Name: 3-hydroxy-2-(p-tolyl)propionic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CO)C(=O)OC2CC3CCC(C2)N3C

Isomeric SMILES

CC1=CC=C(C=C1)C(CO)C(=O)OC2CC3CCC(C2)N3C

InChI

InChI=1S/C18H25NO3/c1-12-3-5-13(6-4-12)17(11-20)18(21)22-16-9-14-7-8-15(10-16)19(14)2/h3-6,14-17,20H,7-11H2,1-2H3