[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 4-methanoylbenzoate

Systemtic Name: [2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 4-methanoylbenzoate Openeye Name: [2-(4-butylanilino)-2-oxo-ethyl] 4-formylbenzoate CAS Name: 4-formylbenzoic acid [2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butylanilino)-2-oxoethyl] 4-formylbenzoate Traditional Name: 4-formylbenzoic acid [2-(4-butylanilino)-2-keto-ethyl] ester Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C=O

InChI

InChI=1S/C20H21NO4/c1-2-3-4-15-7-11-18(12-8-15)21-19(23)14-25-20(24)17-9-5-16(13-22)6-10-17/h5-13H,2-4,14H2,1H3,(H,21,23)