5-[(2E)-2-[(4-nitrophenyl)methylidene]hydrazinyl]-6-(4-pentoxyphenyl)-1,2-diazinan-3-one

Systemtic Name: 5-[(2E)-2-[(4-nitrophenyl)methylidene]hydrazinyl]-6-(4-pentoxyphenyl)-1,2-diazinan-3-one Openeye Name: 5-[(2E)-2-[(4-nitrophenyl)methylene]hydrazino]-6-(4-pentoxyphenyl)hexahydropyridazin-3-one CAS Name: 5-[(2E)-2-[(4-nitrophenyl)methylidene]hydrazinyl]-6-(4-pentoxyphenyl)-3-diazinanone IUPAC Name: 5-[(2E)-2-[(4-nitrophenyl)methylidene]hydrazinyl]-6-(4-pentoxyphenyl)diazinan-3-one Traditional Name: 6-(4-amoxyphenyl)-5-[(N'E)-N'-(4-nitrobenzylidene)hydrazino]hexahydropyridazin-3-one Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2C(CC(=O)NN2)NN=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2C(CC(=O)NN2)N/N=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H27N5O4/c1-2-3-4-13-31-19-11-7-17(8-12-19)22-20(14-21(28)25-26-22)24-23-15-16-5-9-18(10-6-16)27(29)30/h5-12,15,20,22,24,26H,2-4,13-14H2,1H3,(H,25,28)/b23-15+