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

Systemtic Name: 6-ethanoyl-4-[[4-[4-(2-ethoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]-1,4-benzoxazin-3-one Openeye Name: 6-acetyl-4-[[4-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzoxazin-3-one CAS Name: 6-acetyl-4-[[4-[[4-(2-ethoxyphenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]-1,4-benzoxazin-3-one IUPAC Name: 6-acetyl-4-[[4-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzoxazin-3-one Traditional Name: 6-acetyl-4-[4-(4-o-phenetylpiperazine-1-carbonyl)benzyl]-1,4-benzoxazin-3-one Formula: C30H31N3O5 MolecularWeight: 513.58424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C(=O)COC5=C4C=C(C=C5)C(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C(=O)COC5=C4C=C(C=C5)C(=O)C

InChI

InChI=1S/C30H31N3O5/c1-3-37-27-7-5-4-6-25(27)31-14-16-32(17-15-31)30(36)23-10-8-22(9-11-23)19-33-26-18-24(21(2)34)12-13-28(26)38-20-29(33)35/h4-13,18H,3,14-17,19-20H2,1-2H3