[1-oxidanylidene-1-(phenethylamino)propan-2-yl] (E)-3-(2,5-dimethoxyphenyl)prop-2-enoate

Systemtic Name: [1-oxidanylidene-1-(phenethylamino)propan-2-yl] (E)-3-(2,5-dimethoxyphenyl)prop-2-enoate Openeye Name: [1-methyl-2-oxo-2-(phenethylamino)ethyl] (E)-3-(2,5-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,5-dimethoxyphenyl)-2-propenoic acid [1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(phenethylamino)propan-2-yl] (E)-3-(2,5-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(2,5-dimethoxyphenyl)acrylic acid [2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)C=CC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)/C=C/C2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C22H25NO5/c1-16(22(25)23-14-13-17-7-5-4-6-8-17)28-21(24)12-9-18-15-19(26-2)10-11-20(18)27-3/h4-12,15-16H,13-14H2,1-3H3,(H,23,25)/b12-9+