3-(5-chloranyl-4,6-dimethyl-1,2-benzoxazol-3-yl)propanoate

Systemtic Name: 3-(5-chloranyl-4,6-dimethyl-1,2-benzoxazol-3-yl)propanoate Openeye Name: 3-(5-chloro-4,6-dimethyl-1,2-benzoxazol-3-yl)propanoate CAS Name: 3-(5-chloro-4,6-dimethyl-1,2-benzoxazol-3-yl)propanoate IUPAC Name: 3-(5-chloro-4,6-dimethyl-1,2-benzoxazol-3-yl)propanoate Traditional Name: 3-(5-chloro-4,6-dimethyl-indoxazen-3-yl)propionate Formula: C12H11ClNO3- MolecularWeight: 252.67364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1Cl)C)C(=NO2)CCC(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C(=C1Cl)C)C(=NO2)CCC(=O)[O-]

InChI

InChI=1S/C12H12ClNO3/c1-6-5-9-11(7(2)12(6)13)8(14-17-9)3-4-10(15)16/h5H,3-4H2,1-2H3,(H,15,16)/p-1