2-methyl-4-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 2-methyl-4-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 2-methyl-4-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 2-methyl-4-[2-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 2-methyl-4-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 4-[2-(4-isovalerylpiperazino)-2-keto-ethyl]-2-methyl-1,4-benzoxazin-3-one Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CC(=O)N3CCN(CC3)C(=O)CC(C)C

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)CC(=O)N3CCN(CC3)C(=O)CC(C)C

InChI

InChI=1S/C20H27N3O4/c1-14(2)12-18(24)21-8-10-22(11-9-21)19(25)13-23-16-6-4-5-7-17(16)27-15(3)20(23)26/h4-7,14-15H,8-13H2,1-3H3