2-[4-(1,2-benzoxazol-3-yl)-3-chloranyl-2-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-(1,2-benzoxazol-3-yl)-3-chloranyl-2-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-(1,2-benzoxazol-3-yl)-3-chloro-2-methyl-phenoxy]acetic acid CAS Name: 2-[4-(1,2-benzoxazol-3-yl)-3-chloro-2-methylphenoxy]acetic acid IUPAC Name: 2-[4-(1,2-benzoxazol-3-yl)-3-chloro-2-methylphenoxy]acetic acid Traditional Name: 2-(3-chloro-4-indoxazen-3-yl-2-methyl-phenoxy)acetic acid Formula: C16H12ClNO4 MolecularWeight: 317.72378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1Cl)C2=NOC3=CC=CC=C32)OCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1Cl)C2=NOC3=CC=CC=C32)OCC(=O)O

InChI

InChI=1S/C16H12ClNO4/c1-9-12(21-8-14(19)20)7-6-11(15(9)17)16-10-4-2-3-5-13(10)22-18-16/h2-7H,8H2,1H3,(H,19,20)