7-[[4-(3,4-dimethylphenyl)piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 7-[[4-(3,4-dimethylphenyl)piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one Openeye Name: 7-[[4-(3,4-dimethylphenyl)piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one CAS Name: 7-[[4-(3,4-dimethylphenyl)-1-piperazinyl]methyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 7-[[4-(3,4-dimethylphenyl)piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one Traditional Name: 7-[[4-(3,4-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=C(C=C(C=C1)N2CCN(CC2)CC3=CC4=C(C=C3)NC(=O)CO4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)CC3=CC4=C(C=C3)NC(=O)CO4)C

InChI

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