4-(4-aminophenyl)-2-azanyl-6-methoxy-pyridine-3,5-dicarbonitrile hydrate hydrochloride

Systemtic Name: 4-(4-aminophenyl)-2-azanyl-6-methoxy-pyridine-3,5-dicarbonitrile hydrate hydrochloride Openeye Name: 2-amino-4-(4-aminophenyl)-6-methoxy-pyridine-3,5-dicarbonitrile hydrate hydrochloride CAS Name: 2-amino-4-(4-aminophenyl)-6-methoxypyridine-3,5-dicarbonitrile hydrate hydrochloride IUPAC Name: 2-amino-4-(4-aminophenyl)-6-methoxypyridine-3,5-dicarbonitrile hydrate hydrochloride Traditional Name: 2-amino-4-(4-aminophenyl)-6-methoxy-dinicotinonitrile hydrate hydrochloride Formula: C14H14ClN5O2 MolecularWeight: 319.74626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=N1)N)C#N)C2=CC=C(C=C2)N)C#N.O.Cl

Isomeric SMILES

COC1=C(C(=C(C(=N1)N)C#N)C2=CC=C(C=C2)N)C#N.O.Cl

InChI

InChI=1S/C14H11N5O.ClH.H2O/c1-20-14-11(7-16)12(10(6-15)13(18)19-14)8-2-4-9(17)5-3-8;;/h2-5H,17H2,1H3,(H2,18,19);1H;1H2