methyl (1R,5S)-3-[(R)-acetamido(phenyl)methyl]-5-ethoxy-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1R,5S)-3-[(R)-acetamido(phenyl)methyl]-5-ethoxy-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1R,5S)-3-[(R)-acetamido(phenyl)methyl]-5-ethoxy-cyclohex-3-ene-1-carboxylate CAS Name: (1R,5S)-3-[(R)-acetamido(phenyl)methyl]-5-ethoxy-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-3-[(R)-acetamido(phenyl)methyl]-5-ethoxycyclohex-3-ene-1-carboxylate Traditional Name: (1R,5S)-3-[(R)-acetamido(phenyl)methyl]-5-ethoxy-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC(CC(=C1)C(C2=CC=CC=C2)NC(=O)C)C(=O)OC

Isomeric SMILES

CCO[C@H]1C[C@@H](CC(=C1)[C@H](C2=CC=CC=C2)NC(=O)C)C(=O)OC

InChI

InChI=1S/C19H25NO4/c1-4-24-17-11-15(10-16(12-17)19(22)23-3)18(20-13(2)21)14-8-6-5-7-9-14/h5-9,11,16-18H,4,10,12H2,1-3H3,(H,20,21)/t16-,17-,18+/m1/s1