[2-[4-(butanoylamino)phenyl]-2-oxidanylidene-ethyl] 3-acetamidobenzoate

Systemtic Name: [2-[4-(butanoylamino)phenyl]-2-oxidanylidene-ethyl] 3-acetamidobenzoate Openeye Name: [2-[4-(butanoylamino)phenyl]-2-oxo-ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [2-oxo-2-[4-(1-oxobutylamino)phenyl]ethyl] ester IUPAC Name: [2-[4-(butanoylamino)phenyl]-2-oxoethyl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [2-(4-butyramidophenyl)-2-keto-ethyl] ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C

InChI

InChI=1S/C21H22N2O5/c1-3-5-20(26)23-17-10-8-15(9-11-17)19(25)13-28-21(27)16-6-4-7-18(12-16)22-14(2)24/h4,6-12H,3,5,13H2,1-2H3,(H,22,24)(H,23,26)