6-(2-chloranylethanoylamino)-3-ethoxycarbonyl-2,4-dimethyl-benzoic acid

Systemtic Name: 6-(2-chloranylethanoylamino)-3-ethoxycarbonyl-2,4-dimethyl-benzoic acid Openeye Name: 6-[(2-chloroacetyl)amino]-3-ethoxycarbonyl-2,4-dimethyl-benzoic acid CAS Name: 6-[(2-chloro-1-oxoethyl)amino]-3-ethoxycarbonyl-2,4-dimethylbenzoic acid IUPAC Name: 6-[(2-chloroacetyl)amino]-3-ethoxycarbonyl-2,4-dimethylbenzoic acid Traditional Name: 3-carbethoxy-6-[(2-chloroacetyl)amino]-2,4-dimethyl-benzoic acid Formula: C14H16ClNO5 MolecularWeight: 313.73354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1C)NC(=O)CCl)C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1C)NC(=O)CCl)C(=O)O)C

InChI

InChI=1S/C14H16ClNO5/c1-4-21-14(20)11-7(2)5-9(16-10(17)6-15)12(8(11)3)13(18)19/h5H,4,6H2,1-3H3,(H,16,17)(H,18,19)