[2-[4-(acetamidomethyl)phenyl]-2-oxidanylidene-ethyl] 3-(1,3-benzoxazol-2-yl)propanoate

Systemtic Name: [2-[4-(acetamidomethyl)phenyl]-2-oxidanylidene-ethyl] 3-(1,3-benzoxazol-2-yl)propanoate Openeye Name: [2-[4-(acetamidomethyl)phenyl]-2-oxo-ethyl] 3-(1,3-benzoxazol-2-yl)propanoate CAS Name: 3-(1,3-benzoxazol-2-yl)propanoic acid [2-[4-(acetamidomethyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(acetamidomethyl)phenyl]-2-oxoethyl] 3-(1,3-benzoxazol-2-yl)propanoate Traditional Name: 3-(1,3-benzoxazol-2-yl)propionic acid [2-[4-(acetamidomethyl)phenyl]-2-keto-ethyl] ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C(=O)COC(=O)CCC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C(=O)COC(=O)CCC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C21H20N2O5/c1-14(24)22-12-15-6-8-16(9-7-15)18(25)13-27-21(26)11-10-20-23-17-4-2-3-5-19(17)28-20/h2-9H,10-13H2,1H3,(H,22,24)