methyl 4-[(E)-3-oxidanylidene-3-[(2R)-1-oxidanylidene-1-(phenethylamino)propan-2-yl]oxy-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-oxidanylidene-3-[(2R)-1-oxidanylidene-1-(phenethylamino)propan-2-yl]oxy-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[(1R)-1-methyl-2-oxo-2-(phenethylamino)ethoxy]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-oxo-3-[(2R)-1-oxo-1-(phenethylamino)propan-2-yl]oxyprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-oxo-3-[(2R)-1-oxo-1-(phenethylamino)propan-2-yl]oxyprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-[(1R)-2-keto-1-methyl-2-(phenethylamino)ethoxy]prop-1-enyl]benzoic acid methyl ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC=CC=C1)OC(=O)/C=C/C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C22H23NO5/c1-16(21(25)23-15-14-17-6-4-3-5-7-17)28-20(24)13-10-18-8-11-19(12-9-18)22(26)27-2/h3-13,16H,14-15H2,1-2H3,(H,23,25)/b13-10+/t16-/m1/s1