6-tert-butyl-4-[[5-[4-(diphenylmethyl)piperazin-1-yl]carbonylfuran-2-yl]methyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-tert-butyl-4-[[5-[4-(diphenylmethyl)piperazin-1-yl]carbonylfuran-2-yl]methyl]-1,4-benzoxazin-3-one Openeye Name: 4-[[5-(4-benzhydrylpiperazine-1-carbonyl)-2-furyl]methyl]-6-tert-butyl-1,4-benzoxazin-3-one CAS Name: 6-tert-butyl-4-[[5-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-2-furanyl]methyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[[5-(4-benzhydrylpiperazine-1-carbonyl)furan-2-yl]methyl]-6-tert-butyl-1,4-benzoxazin-3-one Traditional Name: 4-[[5-(4-benzhydrylpiperazine-1-carbonyl)-2-furyl]methyl]-6-tert-butyl-1,4-benzoxazin-3-one Formula: C35H37N3O4 MolecularWeight: 563.68598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=C(O3)C(=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=C(O3)C(=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H37N3O4/c1-35(2,3)27-14-16-30-29(22-27)38(32(39)24-41-30)23-28-15-17-31(42-28)34(40)37-20-18-36(19-21-37)33(25-10-6-4-7-11-25)26-12-8-5-9-13-26/h4-17,22,33H,18-21,23-24H2,1-3H3