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

Systemtic Name: 6-ethanoyl-4-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,4-benzoxazin-3-one Openeye Name: 6-acetyl-4-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-oxo-butyl]-1,4-benzoxazin-3-one CAS Name: 6-acetyl-4-[4-[4-(2-ethoxyphenyl)-1-piperazinyl]-4-oxobutyl]-1,4-benzoxazin-3-one IUPAC Name: 6-acetyl-4-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-oxobutyl]-1,4-benzoxazin-3-one Traditional Name: 6-acetyl-4-[4-keto-4-(4-o-phenetylpiperazino)butyl]-1,4-benzoxazin-3-one Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CCCN3C(=O)COC4=C3C=C(C=C4)C(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CCCN3C(=O)COC4=C3C=C(C=C4)C(=O)C

InChI

InChI=1S/C26H31N3O5/c1-3-33-23-8-5-4-7-21(23)27-13-15-28(16-14-27)25(31)9-6-12-29-22-17-20(19(2)30)10-11-24(22)34-18-26(29)32/h4-5,7-8,10-11,17H,3,6,9,12-16,18H2,1-2H3