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

Systemtic Name: 4-[4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-(2-methylbutan-2-yl)-1,4-benzoxazin-3-one Openeye Name: 4-[4-(4-benzhydrylpiperazin-1-yl)-4-oxo-butyl]-6-(1,1-dimethylpropyl)-1,4-benzoxazin-3-one CAS Name: 4-[4-[4-(diphenylmethyl)-1-piperazinyl]-4-oxobutyl]-6-(2-methylbutan-2-yl)-1,4-benzoxazin-3-one IUPAC Name: 4-[4-(4-benzhydrylpiperazin-1-yl)-4-oxobutyl]-6-(2-methylbutan-2-yl)-1,4-benzoxazin-3-one Traditional Name: 6-tert-amyl-4-[4-(4-benzhydrylpiperazino)-4-keto-butyl]-1,4-benzoxazin-3-one Formula: C34H41N3O3 MolecularWeight: 539.70764

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CCCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CCCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H41N3O3/c1-4-34(2,3)28-17-18-30-29(24-28)37(32(39)25-40-30)19-11-16-31(38)35-20-22-36(23-21-35)33(26-12-7-5-8-13-26)27-14-9-6-10-15-27/h5-10,12-15,17-18,24,33H,4,11,16,19-23,25H2,1-3H3