4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-1-[2-(methoxymethyl)pyrrolidin-1-yl]phthalazine-6-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-1-[2-(methoxymethyl)pyrrolidin-1-yl]phthalazine-6-carbonitrile Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-1-[2-(methoxymethyl)pyrrolidin-1-yl]phthalazine-6-carbonitrile CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-1-[2-(methoxymethyl)-1-pyrrolidinyl]-6-phthalazinecarbonitrile IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-1-[2-(methoxymethyl)pyrrolidin-1-yl]phthalazine-6-carbonitrile Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-1-[2-(methoxymethyl)pyrrolidino]phthalazine-6-carbonitrile Formula: C23H24ClN5O2 MolecularWeight: 437.92196

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CCCN1C2=NN=C(C3=C2C=CC(=C3)C#N)NCC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

COCC1CCCN1C2=NN=C(C3=C2C=CC(=C3)C#N)NCC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C23H24ClN5O2/c1-30-14-17-4-3-9-29(17)23-18-7-5-15(12-25)10-19(18)22(27-28-23)26-13-16-6-8-21(31-2)20(24)11-16/h5-8,10-11,17H,3-4,9,13-14H2,1-2H3,(H,26,27)