[3-[(1S)-2-(methylamino)-1-oxidanyl-ethyl]phenyl] benzoate

Systemtic Name: [3-[(1S)-2-(methylamino)-1-oxidanyl-ethyl]phenyl] benzoate Openeye Name: [3-[(1S)-1-hydroxy-2-(methylamino)ethyl]phenyl] benzoate CAS Name: benzoic acid [3-[(1S)-1-hydroxy-2-(methylamino)ethyl]phenyl] ester IUPAC Name: [3-[(1S)-1-hydroxy-2-(methylamino)ethyl]phenyl] benzoate Traditional Name: benzoic acid [3-[(1S)-1-hydroxy-2-(methylamino)ethyl]phenyl] ester Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CNCC(C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2)O

Isomeric SMILES

CNC[C@H](C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C16H17NO3/c1-17-11-15(18)13-8-5-9-14(10-13)20-16(19)12-6-3-2-4-7-12/h2-10,15,17-18H,11H2,1H3/t15-/m1/s1