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

Systemtic Name: 6-tert-butyl-4-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 4-[2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl]-6-tert-butyl-1,4-benzoxazin-3-one CAS Name: 6-tert-butyl-4-[2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]-6-tert-butyl-1,4-benzoxazin-3-one Traditional Name: 4-[2-(4-benzhydrylpiperazino)-2-keto-ethyl]-6-tert-butyl-1,4-benzoxazin-3-one Formula: C31H35N3O3 MolecularWeight: 497.6279

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H35N3O3/c1-31(2,3)25-14-15-27-26(20-25)34(29(36)22-37-27)21-28(35)32-16-18-33(19-17-32)30(23-10-6-4-7-11-23)24-12-8-5-9-13-24/h4-15,20,30H,16-19,21-22H2,1-3H3