[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-chloranyl-2-oxidanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-chloranyl-2-oxidanyl-benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 4-chloro-2-hydroxy-benzoate CAS Name: 4-chloro-2-hydroxybenzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 4-chloro-2-hydroxybenzoate Traditional Name: 4-chloro-2-hydroxy-benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C14H18ClNO4 MolecularWeight: 299.75002

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=C(C=C(C=C1)Cl)O

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=C(C=C(C=C1)Cl)O

InChI

InChI=1S/C14H18ClNO4/c1-3-10(4-2)16-13(18)8-20-14(19)11-6-5-9(15)7-12(11)17/h5-7,10,17H,3-4,8H2,1-2H3,(H,16,18)