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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCCC1CN(C)C)OC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCCC1(CCCCC1CN(C)C)OC(=O)/C=C\C2=CC=CC=C2

InChI

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