3-[2-[(2-methylphenyl)amino]-1,3-benzoxazol-6-yl]propanoic acid

Systemtic Name: 3-[2-[(2-methylphenyl)amino]-1,3-benzoxazol-6-yl]propanoic acid Openeye Name: 3-[2-(2-methylanilino)-1,3-benzoxazol-6-yl]propanoic acid CAS Name: 3-[2-(2-methylanilino)-1,3-benzoxazol-6-yl]propanoic acid IUPAC Name: 3-[2-(2-methylanilino)-1,3-benzoxazol-6-yl]propanoic acid Traditional Name: 3-[2-(o-toluidino)-1,3-benzoxazol-6-yl]propionic acid Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC3=C(O2)C=C(C=C3)CCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC2=NC3=C(O2)C=C(C=C3)CCC(=O)O

InChI

InChI=1S/C17H16N2O3/c1-11-4-2-3-5-13(11)18-17-19-14-8-6-12(7-9-16(20)21)10-15(14)22-17/h2-6,8,10H,7,9H2,1H3,(H,18,19)(H,20,21)