4-[bis(azanyl)methylideneamino]butyl 3-methoxy-4-oxidanyl-benzoate

Systemtic Name: 4-[bis(azanyl)methylideneamino]butyl 3-methoxy-4-oxidanyl-benzoate Openeye Name: 4-guanidinobutyl 4-hydroxy-3-methoxy-benzoate CAS Name: 4-hydroxy-3-methoxybenzoic acid 4-(diaminomethylideneamino)butyl ester IUPAC Name: 4-(diaminomethylideneamino)butyl 4-hydroxy-3-methoxybenzoate Traditional Name: 4-hydroxy-3-methoxy-benzoic acid 4-guanidinobutyl ester Formula: C13H19N3O4 MolecularWeight: 281.30766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCCCCN=C(N)N)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCCCCN=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)