bis(azanyl)methylidene-[4-(3-methoxy-4-oxidanyl-phenyl)carbonyloxybutyl]azanium

Systemtic Name: bis(azanyl)methylidene-[4-(3-methoxy-4-oxidanyl-phenyl)carbonyloxybutyl]azanium Openeye Name: diaminomethylene-[4-(4-hydroxy-3-methoxy-benzoyl)oxybutyl]ammonium CAS Name: diaminomethylidene-[4-[(4-hydroxy-3-methoxyphenyl)-oxomethoxy]butyl]ammonium IUPAC Name: diaminomethylidene-[4-(4-hydroxy-3-methoxybenzoyl)oxybutyl]azanium Traditional Name: diaminomethylene(4-vanilloyloxybutyl)ammonium Formula: C13H20N3O4+ MolecularWeight: 282.3156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCCCC[NH+]=C(N)N)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCCCC[NH+]=C(N)N)O

InChI

InChI=1S/C13H19N3O4/c1-19-11-8-9(4-5-10(11)17)12(18)20-7-3-2-6-16-13(14)15/h4-5,8,17H,2-3,6-7H2,1H3,(H4,14,15,16)/p+1