[2-(2-methylpropylamino)-2-oxidanylidene-ethyl] (E)-3-(4-phenylmethoxyphenyl)prop-2-enoate

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] (E)-3-(4-phenylmethoxyphenyl)prop-2-enoate Openeye Name: [2-(isobutylamino)-2-oxo-ethyl] (E)-3-(4-benzyloxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-phenylmethoxyphenyl)-2-propenoic acid [2-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] (E)-3-(4-phenylmethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-benzoxyphenyl)acrylic acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC(=O)C=CC1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CNC(=O)COC(=O)/C=C/C1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C22H25NO4/c1-17(2)14-23-21(24)16-27-22(25)13-10-18-8-11-20(12-9-18)26-15-19-6-4-3-5-7-19/h3-13,17H,14-16H2,1-2H3,(H,23,24)/b13-10+