3-[3-(benzotriazol-2-yl)-4-methyl-phenyl]propanoic acid

Systemtic Name: 3-[3-(benzotriazol-2-yl)-4-methyl-phenyl]propanoic acid Openeye Name: 3-[3-(benzotriazol-2-yl)-4-methyl-phenyl]propanoic acid CAS Name: 3-[3-(2-benzotriazolyl)-4-methylphenyl]propanoic acid IUPAC Name: 3-[3-(benzotriazol-2-yl)-4-methylphenyl]propanoic acid Traditional Name: 3-[3-(benzotriazol-2-yl)-4-methyl-phenyl]propionic acid Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)O)N2N=C3C=CC=CC3=N2

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)O)N2N=C3C=CC=CC3=N2

InChI

InChI=1S/C16H15N3O2/c1-11-6-7-12(8-9-16(20)21)10-15(11)19-17-13-4-2-3-5-14(13)18-19/h2-7,10H,8-9H2,1H3,(H,20,21)