trimethyl-[12-[(4Z)-4-[(4-nitrophenyl)hydrazinylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]oxydodecyl]azanium

Systemtic Name: trimethyl-[12-[(4Z)-4-[(4-nitrophenyl)hydrazinylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]oxydodecyl]azanium Openeye Name: trimethyl-[12-[(4Z)-4-[(4-nitrophenyl)hydrazono]-3-oxo-cyclohexa-1,5-dien-1-yl]oxydodecyl]ammonium CAS Name: trimethyl-[12-[[(4Z)-4-[(4-nitrophenyl)hydrazinylidene]-3-oxo-1-cyclohexa-1,5-dienyl]oxy]dodecyl]ammonium IUPAC Name: trimethyl-[12-[(4Z)-4-[(4-nitrophenyl)hydrazinylidene]-3-oxocyclohexa-1,5-dien-1-yl]oxydodecyl]azanium Traditional Name: 12-[(4Z)-3-keto-4-[(4-nitrophenyl)hydrazono]cyclohexa-1,5-dien-1-yl]oxydodecyl-trimethyl-ammonium Formula: C27H41N4O4+ MolecularWeight: 485.63884

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCCCCCCCCCCOC1=CC(=O)C(=NNC2=CC=C(C=C2)[N+](=O)[O-])C=C1

Isomeric SMILES

C[N+](C)(C)CCCCCCCCCCCCOC1=CC(=O)/C(=N\NC2=CC=C(C=C2)[N+](=O)[O-])/C=C1

InChI

InChI=1S/C27H40N4O4/c1-31(2,3)20-12-10-8-6-4-5-7-9-11-13-21-35-25-18-19-26(27(32)22-25)29-28-23-14-16-24(17-15-23)30(33)34/h14-19,22H,4-13,20-21H2,1-3H3/p+1