6-tert-butyl-4-[[3-[4-(2-methoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-tert-butyl-4-[[3-[4-(2-methoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]-1,4-benzoxazin-3-one Openeye Name: 6-tert-butyl-4-[[3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzoxazin-3-one CAS Name: 6-tert-butyl-4-[[3-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]-1,4-benzoxazin-3-one IUPAC Name: 6-tert-butyl-4-[[3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzoxazin-3-one Traditional Name: 6-tert-butyl-4-[3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]benzyl]-1,4-benzoxazin-3-one Formula: C31H35N3O4 MolecularWeight: 513.6273

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC(=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C31H35N3O4/c1-31(2,3)24-12-13-28-26(19-24)34(29(35)21-38-28)20-22-8-7-9-23(18-22)30(36)33-16-14-32(15-17-33)25-10-5-6-11-27(25)37-4/h5-13,18-19H,14-17,20-21H2,1-4H3