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

Systemtic Name: 6-ethanoyl-4-[[3-[4-(2-ethoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]-1,4-benzoxazin-3-one Openeye Name: 6-acetyl-4-[[3-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzoxazin-3-one CAS Name: 6-acetyl-4-[[3-[[4-(2-ethoxyphenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]-1,4-benzoxazin-3-one IUPAC Name: 6-acetyl-4-[[3-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzoxazin-3-one Traditional Name: 6-acetyl-4-[3-(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(=CC=C3)CN4C(=O)COC5=C4C=C(C=C5)C(=O)C

Isomeric SMILES

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

InChI

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