4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-1-[2-(1-oxidanylcyclopentyl)ethyl]phthalazine-6-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-1-[2-(1-oxidanylcyclopentyl)ethyl]phthalazine-6-carbonitrile Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-1-[2-(1-hydroxycyclopentyl)ethyl]phthalazine-6-carbonitrile CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-1-[2-(1-hydroxycyclopentyl)ethyl]-6-phthalazinecarbonitrile IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-1-[2-(1-hydroxycyclopentyl)ethyl]phthalazine-6-carbonitrile Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-1-[2-(1-hydroxycyclopentyl)ethyl]phthalazine-6-carbonitrile Formula: C24H25ClN4O2 MolecularWeight: 436.9339

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NN=C(C3=C2C=C(C=C3)C#N)CCC4(CCCC4)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NN=C(C3=C2C=C(C=C3)C#N)CCC4(CCCC4)O)Cl

InChI

InChI=1S/C24H25ClN4O2/c1-31-22-7-5-17(13-20(22)25)15-27-23-19-12-16(14-26)4-6-18(19)21(28-29-23)8-11-24(30)9-2-3-10-24/h4-7,12-13,30H,2-3,8-11,15H2,1H3,(H,27,29)