ethyl (Z)-3-cyano-3-(1-cyano-4-methyl-4-phenylmethoxy-cyclohexyl)-2-oxidanyl-prop-2-enoate

Systemtic Name: ethyl (Z)-3-cyano-3-(1-cyano-4-methyl-4-phenylmethoxy-cyclohexyl)-2-oxidanyl-prop-2-enoate Openeye Name: ethyl (Z)-3-(4-benzyloxy-1-cyano-4-methyl-cyclohexyl)-3-cyano-2-hydroxy-prop-2-enoate CAS Name: (Z)-3-cyano-3-(1-cyano-4-methyl-4-phenylmethoxycyclohexyl)-2-hydroxy-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-cyano-3-(1-cyano-4-methyl-4-phenylmethoxycyclohexyl)-2-hydroxyprop-2-enoate Traditional Name: (Z)-3-(4-benzoxy-1-cyano-4-methyl-cyclohexyl)-3-cyano-2-hydroxy-acrylic acid ethyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C#N)C1(CCC(CC1)(C)OCC2=CC=CC=C2)C#N)O

Isomeric SMILES

CCOC(=O)/C(=C(/C#N)\C1(CCC(CC1)(C)OCC2=CC=CC=C2)C#N)/O

InChI

InChI=1S/C21H24N2O4/c1-3-26-19(25)18(24)17(13-22)21(15-23)11-9-20(2,10-12-21)27-14-16-7-5-4-6-8-16/h4-8,24H,3,9-12,14H2,1-2H3/b18-17+