[4-[[(3R)-3-(dimethylaminomethyl)-2-oxidanylidene-cyclohexylidene]methyl]phenyl] 3-phenylprop-2-enoate

Systemtic Name: [4-[[(3R)-3-(dimethylaminomethyl)-2-oxidanylidene-cyclohexylidene]methyl]phenyl] 3-phenylprop-2-enoate Openeye Name: [4-[[(3R)-3-(dimethylaminomethyl)-2-oxo-cyclohexylidene]methyl]phenyl] 3-phenylprop-2-enoate CAS Name: 3-phenyl-2-propenoic acid [4-[[(3R)-3-(dimethylaminomethyl)-2-oxocyclohexylidene]methyl]phenyl] ester IUPAC Name: [4-[[(3R)-3-(dimethylaminomethyl)-2-oxocyclohexylidene]methyl]phenyl] 3-phenylprop-2-enoate Traditional Name: 3-phenylacrylic acid [4-[[(3R)-3-(dimethylaminomethyl)-2-keto-cyclohexylidene]methyl]phenyl] ester Formula: C25H27NO3 MolecularWeight: 389.48678

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCCC(=CC2=CC=C(C=C2)OC(=O)C=CC3=CC=CC=C3)C1=O

Isomeric SMILES

CN(C)C[C@H]1CCCC(=CC2=CC=C(C=C2)OC(=O)C=CC3=CC=CC=C3)C1=O

InChI

InChI=1S/C25H27NO3/c1-26(2)18-22-10-6-9-21(25(22)28)17-20-11-14-23(15-12-20)29-24(27)16-13-19-7-4-3-5-8-19/h3-5,7-8,11-17,22H,6,9-10,18H2,1-2H3/t22-/m1/s1