bis(azanyl)methylidene-[[3-chloranyl-4-(7-methyloctoxy)phenyl]methyl]azanium

Systemtic Name: bis(azanyl)methylidene-[[3-chloranyl-4-(7-methyloctoxy)phenyl]methyl]azanium Openeye Name: [3-chloro-4-(7-methyloctoxy)phenyl]methyl-(diaminomethylene)ammonium CAS Name: [3-chloro-4-(7-methyloctoxy)phenyl]methyl-(diaminomethylidene)ammonium IUPAC Name: [3-chloro-4-(7-methyloctoxy)phenyl]methyl-(diaminomethylidene)azanium Traditional Name: [3-chloro-4-(7-methyloctoxy)benzyl]-(diaminomethylene)ammonium Formula: C17H29ClN3O+ MolecularWeight: 326.88466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCOC1=C(C=C(C=C1)C[NH+]=C(N)N)Cl

Isomeric SMILES

CC(C)CCCCCCOC1=C(C=C(C=C1)C[NH+]=C(N)N)Cl

InChI

InChI=1S/C17H28ClN3O/c1-13(2)7-5-3-4-6-10-22-16-9-8-14(11-15(16)18)12-21-17(19)20/h8-9,11,13H,3-7,10,12H2,1-2H3,(H4,19,20,21)/p+1