methyl 3-[3-(2,3-dimethylphenoxy)propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[3-(2,3-dimethylphenoxy)propanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[3-(2,3-dimethylphenoxy)propanoylamino]-3-phenyl-propanoate CAS Name: 3-[[3-(2,3-dimethylphenoxy)-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[3-(2,3-dimethylphenoxy)propanoylamino]-3-phenylpropanoate Traditional Name: 3-[3-(2,3-dimethylphenoxy)propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCCC(=O)NC(CC(=O)OC)C2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCCC(=O)NC(CC(=O)OC)C2=CC=CC=C2)C

InChI

InChI=1S/C21H25NO4/c1-15-8-7-11-19(16(15)2)26-13-12-20(23)22-18(14-21(24)25-3)17-9-5-4-6-10-17/h4-11,18H,12-14H2,1-3H3,(H,22,23)