2-[3-(2-chloranyl-3-methoxy-phenyl)propanoylamino]ethanoic acid

Systemtic Name: 2-[3-(2-chloranyl-3-methoxy-phenyl)propanoylamino]ethanoic acid Openeye Name: 2-[3-(2-chloro-3-methoxy-phenyl)propanoylamino]acetic acid CAS Name: 2-[[3-(2-chloro-3-methoxyphenyl)-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[3-(2-chloro-3-methoxyphenyl)propanoylamino]acetic acid Traditional Name: 2-[3-(2-chloro-3-methoxy-phenyl)propanoylamino]acetic acid Formula: C12H14ClNO4 MolecularWeight: 271.69686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1Cl)CCC(=O)NCC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1Cl)CCC(=O)NCC(=O)O

InChI

InChI=1S/C12H14ClNO4/c1-18-9-4-2-3-8(12(9)13)5-6-10(15)14-7-11(16)17/h2-4H,5-7H2,1H3,(H,14,15)(H,16,17)