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

Systemtic Name: 6-tert-butyl-4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-tert-butyl-4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 6-tert-butyl-4-[2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-tert-butyl-4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 6-tert-butyl-4-[2-keto-2-[4-(2-methoxyphenyl)piperazino]ethyl]-1,4-benzoxazin-3-one Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C25H31N3O4/c1-25(2,3)18-9-10-22-20(15-18)28(24(30)17-32-22)16-23(29)27-13-11-26(12-14-27)19-7-5-6-8-21(19)31-4/h5-10,15H,11-14,16-17H2,1-4H3