[2-[[(1S,2R)-2-methylcyclohexyl]amino]-2-oxidanylidene-ethyl] (E)-3-phenylprop-2-enoate

Systemtic Name: [2-[[(1S,2R)-2-methylcyclohexyl]amino]-2-oxidanylidene-ethyl] (E)-3-phenylprop-2-enoate Openeye Name: [2-[[(1S,2R)-2-methylcyclohexyl]amino]-2-oxo-ethyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [2-[[(1S,2R)-2-methylcyclohexyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S,2R)-2-methylcyclohexyl]amino]-2-oxoethyl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [2-keto-2-[[(1S,2R)-2-methylcyclohexyl]amino]ethyl] ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)COC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H23NO3/c1-14-7-5-6-10-16(14)19-17(20)13-22-18(21)12-11-15-8-3-2-4-9-15/h2-4,8-9,11-12,14,16H,5-7,10,13H2,1H3,(H,19,20)/b12-11+/t14-,16+/m1/s1