methyl (3R)-3-[[4-(4-ethoxyphenyl)-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (3R)-3-[[4-(4-ethoxyphenyl)-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (3R)-3-[[4-(4-ethoxyphenyl)-4-oxo-butanoyl]amino]-3-phenyl-propanoate CAS Name: (3R)-3-[[4-(4-ethoxyphenyl)-1,4-dioxobutyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (3R)-3-[[4-(4-ethoxyphenyl)-4-oxobutanoyl]amino]-3-phenylpropanoate Traditional Name: (3R)-3-[(4-keto-4-p-phenetyl-butanoyl)amino]-3-phenyl-propionic acid methyl ester Formula: C22H25NO5 MolecularWeight: 383.4376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)NC(CC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N[C@H](CC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C22H25NO5/c1-3-28-18-11-9-17(10-12-18)20(24)13-14-21(25)23-19(15-22(26)27-2)16-7-5-4-6-8-16/h4-12,19H,3,13-15H2,1-2H3,(H,23,25)/t19-/m1/s1