(phenylmethyl) (2E,4S,5R)-3-(dimethylamino)-4-methyl-5-phenyl-hepta-2,6-dienoate

Systemtic Name: (phenylmethyl) (2E,4S,5R)-3-(dimethylamino)-4-methyl-5-phenyl-hepta-2,6-dienoate Openeye Name: benzyl (2E,4S,5R)-3-(dimethylamino)-4-methyl-5-phenyl-hepta-2,6-dienoate CAS Name: (2E,4S,5R)-3-(dimethylamino)-4-methyl-5-phenylhepta-2,6-dienoic acid (phenylmethyl) ester IUPAC Name: benzyl (2E,4S,5R)-3-(dimethylamino)-4-methyl-5-phenylhepta-2,6-dienoate Traditional Name: (2E,4S,5R)-3-(dimethylamino)-4-methyl-5-phenyl-hepta-2,6-dienoic acid benzyl ester Formula: C23H27NO2 MolecularWeight: 349.46598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C=C)C1=CC=CC=C1)C(=CC(=O)OCC2=CC=CC=C2)N(C)C

Isomeric SMILES

C[C@@H]([C@@H](C=C)C1=CC=CC=C1)/C(=C\C(=O)OCC2=CC=CC=C2)/N(C)C

InChI

InChI=1S/C23H27NO2/c1-5-21(20-14-10-7-11-15-20)18(2)22(24(3)4)16-23(25)26-17-19-12-8-6-9-13-19/h5-16,18,21H,1,17H2,2-4H3/b22-16+/t18-,21+/m0/s1