[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (Z)-2-benzamido-3-oxidanyl-prop-2-enoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (Z)-2-benzamido-3-oxidanyl-prop-2-enoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (Z)-2-benzamido-3-hydroxy-prop-2-enoate CAS Name: (Z)-2-benzamido-3-hydroxy-2-propenoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (Z)-2-benzamido-3-hydroxyprop-2-enoate Traditional Name: (Z)-2-benzamido-3-hydroxy-acrylic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C20H27NO4 MolecularWeight: 345.43268

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(=CO)NC(=O)C2=CC=CC=C2)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H27NO4/c1-13(2)16-10-9-14(3)11-18(16)25-20(24)17(12-22)21-19(23)15-7-5-4-6-8-15/h4-8,12-14,16,18,22H,9-11H2,1-3H3,(H,21,23)/b17-12-/t14-,16+,18-/m1/s1