[(1S,4R)-4-[[(2S)-2-methoxy-2-phenyl-ethanoyl]amino]cyclohex-2-en-1-yl] benzoate

Systemtic Name: [(1S,4R)-4-[[(2S)-2-methoxy-2-phenyl-ethanoyl]amino]cyclohex-2-en-1-yl] benzoate Openeye Name: [(1S,4R)-4-[[(2S)-2-methoxy-2-phenyl-acetyl]amino]cyclohex-2-en-1-yl] benzoate CAS Name: benzoic acid [(1S,4R)-4-[[(2S)-2-methoxy-1-oxo-2-phenylethyl]amino]-1-cyclohex-2-enyl] ester IUPAC Name: [(1S,4R)-4-[[(2S)-2-methoxy-2-phenylacetyl]amino]cyclohex-2-en-1-yl] benzoate Traditional Name: benzoic acid [(1S,4R)-4-[[(2S)-2-methoxy-2-phenyl-acetyl]amino]cyclohex-2-en-1-yl] ester Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=CC=C1)C(=O)NC2CCC(C=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CO[C@@H](C1=CC=CC=C1)C(=O)N[C@@H]2CC[C@@H](C=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H23NO4/c1-26-20(16-8-4-2-5-9-16)21(24)23-18-12-14-19(15-13-18)27-22(25)17-10-6-3-7-11-17/h2-12,14,18-20H,13,15H2,1H3,(H,23,24)/t18-,19+,20-/m0/s1