[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-phenylmethoxybenzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-phenylmethoxybenzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 4-benzyloxybenzoate CAS Name: 4-phenylmethoxybenzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 4-phenylmethoxybenzoate Traditional Name: 4-benzoxybenzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO4/c1-3-18(4-2)22-20(23)15-26-21(24)17-10-12-19(13-11-17)25-14-16-8-6-5-7-9-16/h5-13,18H,3-4,14-15H2,1-2H3,(H,22,23)