4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-1-(3,3,5,5-tetramethyl-4-oxidanyl-piperidin-1-yl)phthalazine-6-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-1-(3,3,5,5-tetramethyl-4-oxidanyl-piperidin-1-yl)phthalazine-6-carbonitrile Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-1-(4-hydroxy-3,3,5,5-tetramethyl-1-piperidyl)phthalazine-6-carbonitrile CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-1-(4-hydroxy-3,3,5,5-tetramethyl-1-piperidinyl)-6-phthalazinecarbonitrile IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-1-(4-hydroxy-3,3,5,5-tetramethylpiperidin-1-yl)phthalazine-6-carbonitrile Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-1-(4-hydroxy-3,3,5,5-tetramethyl-piperidino)phthalazine-6-carbonitrile Formula: C26H30ClN5O2 MolecularWeight: 480.0017

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC(C1O)(C)C)C2=NN=C(C3=C2C=CC(=C3)C#N)NCC4=CC(=C(C=C4)OC)Cl)C

Isomeric SMILES

CC1(CN(CC(C1O)(C)C)C2=NN=C(C3=C2C=CC(=C3)C#N)NCC4=CC(=C(C=C4)OC)Cl)C

InChI

InChI=1S/C26H30ClN5O2/c1-25(2)14-32(15-26(3,4)24(25)33)23-18-8-6-16(12-28)10-19(18)22(30-31-23)29-13-17-7-9-21(34-5)20(27)11-17/h6-11,24,33H,13-15H2,1-5H3,(H,29,30)