(E)-2-cyano-3-(3-methoxy-2-propan-2-yloxy-phenyl)-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3-methoxy-2-propan-2-yloxy-phenyl)-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-(2-isopropoxy-3-methoxy-phenyl)-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(3-methoxy-2-propan-2-yloxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-methoxy-2-propan-2-yloxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-(2-isopropoxy-3-methoxy-phenyl)-N-[(1S,2S)-2-methylcyclohexyl]acrylamide Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(=CC2=C(C(=CC=C2)OC)OC(C)C)C#N

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)/C(=C/C2=C(C(=CC=C2)OC)OC(C)C)/C#N

InChI

InChI=1S/C21H28N2O3/c1-14(2)26-20-16(9-7-11-19(20)25-4)12-17(13-22)21(24)23-18-10-6-5-8-15(18)3/h7,9,11-12,14-15,18H,5-6,8,10H2,1-4H3,(H,23,24)/b17-12+/t15-,18-/m0/s1