6-[2-[(3,5-dimethylphenyl)amino]pyridin-4-yl]-4-methyl-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[(3,5-dimethylphenyl)amino]pyridin-4-yl]-4-methyl-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3,5-dimethylanilino)-4-pyridyl]-4-methyl-1,4-benzoxazin-3-one CAS Name: 6-[2-(3,5-dimethylanilino)-4-pyridinyl]-4-methyl-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3,5-dimethylanilino)pyridin-4-yl]-4-methyl-1,4-benzoxazin-3-one Traditional Name: 6-[2-(3,5-dimethylanilino)-4-pyridyl]-4-methyl-1,4-benzoxazin-3-one Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC=CC(=C2)C3=CC4=C(C=C3)OCC(=O)N4C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC=CC(=C2)C3=CC4=C(C=C3)OCC(=O)N4C)C

InChI

InChI=1S/C22H21N3O2/c1-14-8-15(2)10-18(9-14)24-21-12-17(6-7-23-21)16-4-5-20-19(11-16)25(3)22(26)13-27-20/h4-12H,13H2,1-3H3,(H,23,24)