6-methyl-4-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-methyl-4-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,4-benzoxazin-3-one Openeye Name: 6-methyl-4-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxo-butyl]-1,4-benzoxazin-3-one CAS Name: 6-methyl-4-[4-[4-(4-nitrophenyl)-1-piperazinyl]-4-oxobutyl]-1,4-benzoxazin-3-one IUPAC Name: 6-methyl-4-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutyl]-1,4-benzoxazin-3-one Traditional Name: 4-[4-keto-4-[4-(4-nitrophenyl)piperazino]butyl]-6-methyl-1,4-benzoxazin-3-one Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(=O)N2CCCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(=O)N2CCCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O5/c1-17-4-9-21-20(15-17)26(23(29)16-32-21)10-2-3-22(28)25-13-11-24(12-14-25)18-5-7-19(8-6-18)27(30)31/h4-9,15H,2-3,10-14,16H2,1H3