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

Systemtic Name: 6-tert-butyl-4-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-tert-butyl-4-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 6-tert-butyl-4-[2-[4-(2-ethoxyphenyl)-1-piperazinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-tert-butyl-4-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 6-tert-butyl-4-[2-keto-2-(4-o-phenetylpiperazino)ethyl]-1,4-benzoxazin-3-one Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CN3C(=O)COC4=C3C=C(C=C4)C(C)(C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CN3C(=O)COC4=C3C=C(C=C4)C(C)(C)C

InChI

InChI=1S/C26H33N3O4/c1-5-32-22-9-7-6-8-20(22)27-12-14-28(15-13-27)24(30)17-29-21-16-19(26(2,3)4)10-11-23(21)33-18-25(29)31/h6-11,16H,5,12-15,17-18H2,1-4H3