[1-oxidanylidene-1-(phenethylamino)propan-2-yl] (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate

Systemtic Name: [1-oxidanylidene-1-(phenethylamino)propan-2-yl] (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Openeye Name: [1-methyl-2-oxo-2-(phenethylamino)ethyl] (E)-3-(4-isobutoxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]-2-propenoic acid [1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(phenethylamino)propan-2-yl] (E)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-(4-isobutoxy-3-methoxy-phenyl)acrylic acid [2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C=CC(=O)OC(C)C(=O)NCCC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)/C=C/C(=O)OC(C)C(=O)NCCC2=CC=CC=C2)OC

InChI

InChI=1S/C25H31NO5/c1-18(2)17-30-22-12-10-21(16-23(22)29-4)11-13-24(27)31-19(3)25(28)26-15-14-20-8-6-5-7-9-20/h5-13,16,18-19H,14-15,17H2,1-4H3,(H,26,28)/b13-11+