4-[2-(3-chloranyl-4-methoxy-phenyl)ethylamino]-1-(4-methoxypiperidin-1-yl)phthalazine-6-carbonitrile hydrochloride

Systemtic Name: 4-[2-(3-chloranyl-4-methoxy-phenyl)ethylamino]-1-(4-methoxypiperidin-1-yl)phthalazine-6-carbonitrile hydrochloride Openeye Name: 4-[2-(3-chloro-4-methoxy-phenyl)ethylamino]-1-(4-methoxy-1-piperidyl)phthalazine-6-carbonitrile hydrochloride CAS Name: 4-[2-(3-chloro-4-methoxyphenyl)ethylamino]-1-(4-methoxy-1-piperidinyl)-6-phthalazinecarbonitrile hydrochloride IUPAC Name: 4-[2-(3-chloro-4-methoxyphenyl)ethylamino]-1-(4-methoxypiperidin-1-yl)phthalazine-6-carbonitrile hydrochloride Traditional Name: 4-[2-(3-chloro-4-methoxy-phenyl)ethylamino]-1-(4-methoxypiperidino)phthalazine-6-carbonitrile hydrochloride Formula: C24H27Cl2N5O2 MolecularWeight: 488.40948

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(CC1)C2=NN=C(C3=C2C=CC(=C3)C#N)NCCC4=CC(=C(C=C4)OC)Cl.Cl

Isomeric SMILES

COC1CCN(CC1)C2=NN=C(C3=C2C=CC(=C3)C#N)NCCC4=CC(=C(C=C4)OC)Cl.Cl

InChI

InChI=1S/C24H26ClN5O2.ClH/c1-31-18-8-11-30(12-9-18)24-19-5-3-17(15-26)13-20(19)23(28-29-24)27-10-7-16-4-6-22(32-2)21(25)14-16;/h3-6,13-14,18H,7-12H2,1-2H3,(H,27,28);1H