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

Systemtic Name: 4-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-methyl-1,4-benzoxazin-3-one Openeye Name: 4-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-oxo-butyl]-6-methyl-1,4-benzoxazin-3-one CAS Name: 4-[4-[4-(2-ethoxyphenyl)-1-piperazinyl]-4-oxobutyl]-6-methyl-1,4-benzoxazin-3-one IUPAC Name: 4-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-oxobutyl]-6-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[4-keto-4-(4-o-phenetylpiperazino)butyl]-6-methyl-1,4-benzoxazin-3-one Formula: C25H31N3O4 MolecularWeight: 437.53134

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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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O4/c1-3-31-22-8-5-4-7-20(22)26-13-15-27(16-14-26)24(29)9-6-12-28-21-17-19(2)10-11-23(21)32-18-25(28)30/h4-5,7-8,10-11,17H,3,6,9,12-16,18H2,1-2H3