6-ethanoyl-4-[(2S)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]-1,4-benzoxazin-3-one

Systemtic Name: 6-ethanoyl-4-[(2S)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]-1,4-benzoxazin-3-one Openeye Name: 6-acetyl-4-[(1S)-1-methyl-2-oxo-2-piperazin-1-yl-ethyl]-1,4-benzoxazin-3-one CAS Name: 6-acetyl-4-[(2S)-1-oxo-1-(1-piperazinyl)propan-2-yl]-1,4-benzoxazin-3-one IUPAC Name: 6-acetyl-4-[(2S)-1-oxo-1-piperazin-1-ylpropan-2-yl]-1,4-benzoxazin-3-one Traditional Name: 6-acetyl-4-[(1S)-2-keto-1-methyl-2-piperazino-ethyl]-1,4-benzoxazin-3-one Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNCC1)N2C(=O)COC3=C2C=C(C=C3)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)N1CCNCC1)N2C(=O)COC3=C2C=C(C=C3)C(=O)C

InChI

InChI=1S/C17H21N3O4/c1-11(17(23)19-7-5-18-6-8-19)20-14-9-13(12(2)21)3-4-15(14)24-10-16(20)22/h3-4,9,11,18H,5-8,10H2,1-2H3/t11-/m0/s1