1-[(3-methoxy-4-methyl-phenyl)methylamino]phthalazine-6-carbonitrile hydrochloride

Systemtic Name: 1-[(3-methoxy-4-methyl-phenyl)methylamino]phthalazine-6-carbonitrile hydrochloride Openeye Name: 1-[(3-methoxy-4-methyl-phenyl)methylamino]phthalazine-6-carbonitrile hydrochloride CAS Name: 1-[(3-methoxy-4-methylphenyl)methylamino]-6-phthalazinecarbonitrile hydrochloride IUPAC Name: 1-[(3-methoxy-4-methylphenyl)methylamino]phthalazine-6-carbonitrile hydrochloride Traditional Name: 1-[(3-methoxy-4-methyl-benzyl)amino]phthalazine-6-carbonitrile hydrochloride Formula: C18H17ClN4O MolecularWeight: 340.80678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC2=C3C=CC(=CC3=CN=N2)C#N)OC.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CNC2=C3C=CC(=CC3=CN=N2)C#N)OC.Cl

InChI

InChI=1S/C18H16N4O.ClH/c1-12-3-4-14(8-17(12)23-2)10-20-18-16-6-5-13(9-19)7-15(16)11-21-22-18;/h3-8,11H,10H2,1-2H3,(H,20,22);1H