methyl (1R,6R)-1-benzamido-6-(2-methoxyphenyl)-4-oxidanylidene-cyclohex-2-ene-1-carboxylate

Systemtic Name: methyl (1R,6R)-1-benzamido-6-(2-methoxyphenyl)-4-oxidanylidene-cyclohex-2-ene-1-carboxylate Openeye Name: methyl (1R,6R)-1-benzamido-6-(2-methoxyphenyl)-4-oxo-cyclohex-2-ene-1-carboxylate CAS Name: (1R,6R)-1-benzamido-6-(2-methoxyphenyl)-4-oxo-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,6R)-1-benzamido-6-(2-methoxyphenyl)-4-oxocyclohex-2-ene-1-carboxylate Traditional Name: (1R,6R)-1-benzamido-4-keto-6-(2-methoxyphenyl)cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CC(=O)C=CC2(C(=O)OC)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1[C@H]2CC(=O)C=C[C@@]2(C(=O)OC)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO5/c1-27-19-11-7-6-10-17(19)18-14-16(24)12-13-22(18,21(26)28-2)23-20(25)15-8-4-3-5-9-15/h3-13,18H,14H2,1-2H3,(H,23,25)/t18-,22-/m1/s1