2-[[4-(3,5-dimethylphenyl)piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 2-[[4-(3,5-dimethylphenyl)piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one Openeye Name: 2-[[4-(3,5-dimethylphenyl)piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one CAS Name: 2-[[4-(3,5-dimethylphenyl)-1-piperazinyl]methyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 2-[[4-(3,5-dimethylphenyl)piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one Traditional Name: 2-[[4-(3,5-dimethylphenyl)piperazino]methyl]-4H-1,4-benzoxazin-3-one Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2CCN(CC2)CC3C(=O)NC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2CCN(CC2)CC3C(=O)NC4=CC=CC=C4O3)C

InChI

InChI=1S/C21H25N3O2/c1-15-11-16(2)13-17(12-15)24-9-7-23(8-10-24)14-20-21(25)22-18-5-3-4-6-19(18)26-20/h3-6,11-13,20H,7-10,14H2,1-2H3,(H,22,25)