5-[[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-oxomethyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-carbonyl)amino]methyl]-2-methoxy-benzoic acid Formula: C18H16ClNO6 MolecularWeight: 377.77574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C(=C2)Cl)OCCO3)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C(=C2)Cl)OCCO3)C(=O)O

InChI

InChI=1S/C18H16ClNO6/c1-24-14-3-2-10(6-12(14)18(22)23)9-20-17(21)11-7-13(19)16-15(8-11)25-4-5-26-16/h2-3,6-8H,4-5,9H2,1H3,(H,20,21)(H,22,23)