1-[3-(3-methylphenyl)-2,1-benzoxazol-5-yl]ethanone

Systemtic Name: 1-[3-(3-methylphenyl)-2,1-benzoxazol-5-yl]ethanone Openeye Name: 1-[3-(m-tolyl)-2,1-benzoxazol-5-yl]ethanone CAS Name: 1-[3-(3-methylphenyl)-2,1-benzoxazol-5-yl]ethanone IUPAC Name: 1-[3-(3-methylphenyl)-2,1-benzoxazol-5-yl]ethanone Traditional Name: 1-[3-(m-tolyl)anthranil-5-yl]ethanone Formula: C16H13NO2 MolecularWeight: 251.27992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C3C=C(C=CC3=NO2)C(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C3C=C(C=CC3=NO2)C(=O)C

InChI

InChI=1S/C16H13NO2/c1-10-4-3-5-13(8-10)16-14-9-12(11(2)18)6-7-15(14)17-19-16/h3-9H,1-2H3