(3-methoxyphenyl) 4-[bis(azanyl)methylideneamino]benzoate dihydrochloride

Systemtic Name: (3-methoxyphenyl) 4-[bis(azanyl)methylideneamino]benzoate dihydrochloride Openeye Name: (3-methoxyphenyl) 4-guanidinobenzoate dihydrochloride CAS Name: 4-(diaminomethylideneamino)benzoic acid (3-methoxyphenyl) ester dihydrochloride IUPAC Name: (3-methoxyphenyl) 4-(diaminomethylideneamino)benzoate dihydrochloride Traditional Name: 4-guanidinobenzoic acid (3-methoxyphenyl) ester dihydrochloride Formula: C15H17Cl2N3O3 MolecularWeight: 358.21978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N.Cl.Cl

Isomeric SMILES

COC1=CC=CC(=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N.Cl.Cl

InChI

InChI=1S/C15H15N3O3.2ClH/c1-20-12-3-2-4-13(9-12)21-14(19)10-5-7-11(8-6-10)18-15(16)17;;/h2-9H,1H3,(H4,16,17,18);2*1H