methyl 3-(butanoylamino)-4-chloranyl-benzoate

Systemtic Name: methyl 3-(butanoylamino)-4-chloranyl-benzoate Openeye Name: methyl 3-(butanoylamino)-4-chloro-benzoate CAS Name: 4-chloro-3-(1-oxobutylamino)benzoic acid methyl ester IUPAC Name: methyl 3-(butanoylamino)-4-chlorobenzoate Traditional Name: 3-butyramido-4-chloro-benzoic acid methyl ester Formula: C12H14ClNO3 MolecularWeight: 255.69746

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=CC(=C1)C(=O)OC)Cl

Isomeric SMILES

CCCC(=O)NC1=C(C=CC(=C1)C(=O)OC)Cl

InChI

InChI=1S/C12H14ClNO3/c1-3-4-11(15)14-10-7-8(12(16)17-2)5-6-9(10)13/h5-7H,3-4H2,1-2H3,(H,14,15)