3-[[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]amino]-3H-2-benzofuran-1-one

Systemtic Name: 3-[[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]amino]-3H-2-benzofuran-1-one Openeye Name: 3-[[1-(m-tolylmethyl)-1,2,4-triazol-3-yl]amino]-3H-isobenzofuran-1-one CAS Name: 3-[[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]amino]-3H-isobenzofuran-1-one IUPAC Name: 3-[[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]amino]-3H-2-benzofuran-1-one Traditional Name: 3-[[1-(3-methylbenzyl)-1,2,4-triazol-3-yl]amino]phthalide Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=NC(=N2)NC3C4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=NC(=N2)NC3C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C18H16N4O2/c1-12-5-4-6-13(9-12)10-22-11-19-18(21-22)20-16-14-7-2-3-8-15(14)17(23)24-16/h2-9,11,16H,10H2,1H3,(H,20,21)