methyl 4-acetamido-5-chloranyl-2-oxidanyl-3-prop-2-enyl-benzoate

Systemtic Name: methyl 4-acetamido-5-chloranyl-2-oxidanyl-3-prop-2-enyl-benzoate Openeye Name: methyl 4-acetamido-3-allyl-5-chloro-2-hydroxy-benzoate CAS Name: 4-acetamido-5-chloro-2-hydroxy-3-prop-2-enylbenzoic acid methyl ester IUPAC Name: methyl 4-acetamido-5-chloro-2-hydroxy-3-prop-2-enylbenzoate Traditional Name: 4-acetamido-3-allyl-5-chloro-2-hydroxy-benzoic acid methyl ester Formula: C13H14ClNO4 MolecularWeight: 283.70756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C(=C1CC=C)O)C(=O)OC)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C(=C1CC=C)O)C(=O)OC)Cl

InChI

InChI=1S/C13H14ClNO4/c1-4-5-8-11(15-7(2)16)10(14)6-9(12(8)17)13(18)19-3/h4,6,17H,1,5H2,2-3H3,(H,15,16)