6-ethanoyl-4-[2-oxidanylidene-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-ethanoyl-4-[2-oxidanylidene-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-acetyl-4-[2-[4-[(E)-cinnamyl]piperazin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 6-acetyl-4-[2-oxo-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]ethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-acetyl-4-[2-oxo-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one Traditional Name: 6-acetyl-4-[2-[4-[(E)-cinnamyl]piperazino]-2-keto-ethyl]-1,4-benzoxazin-3-one Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O4/c1-19(29)21-9-10-23-22(16-21)28(25(31)18-32-23)17-24(30)27-14-12-26(13-15-27)11-5-8-20-6-3-2-4-7-20/h2-10,16H,11-15,17-18H2,1H3/b8-5+