[2-(dimethylaminomethyl)-1-propan-2-yl-cyclohexyl] (Z)-3-phenylprop-2-enoate

Systemtic Name: [2-(dimethylaminomethyl)-1-propan-2-yl-cyclohexyl] (Z)-3-phenylprop-2-enoate Openeye Name: [2-(dimethylaminomethyl)-1-isopropyl-cyclohexyl] (Z)-3-phenylprop-2-enoate CAS Name: (Z)-3-phenyl-2-propenoic acid [2-(dimethylaminomethyl)-1-propan-2-ylcyclohexyl] ester IUPAC Name: [2-(dimethylaminomethyl)-1-propan-2-ylcyclohexyl] (Z)-3-phenylprop-2-enoate Traditional Name: (Z)-3-phenylacrylic acid [2-(dimethylaminomethyl)-1-isopropyl-cyclohexyl] ester Formula: C21H31NO2 MolecularWeight: 329.47634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CCCCC1CN(C)C)OC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)C1(CCCCC1CN(C)C)OC(=O)/C=C\C2=CC=CC=C2

InChI

InChI=1S/C21H31NO2/c1-17(2)21(15-9-8-12-19(21)16-22(3)4)24-20(23)14-13-18-10-6-5-7-11-18/h5-7,10-11,13-14,17,19H,8-9,12,15-16H2,1-4H3/b14-13-