4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-3-[(2,2-dimethylpropylamino)methyl]quinoline-6-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-3-[(2,2-dimethylpropylamino)methyl]quinoline-6-carbonitrile Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-3-[(2,2-dimethylpropylamino)methyl]quinoline-6-carbonitrile CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-3-[(2,2-dimethylpropylamino)methyl]-6-quinolinecarbonitrile IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-3-[(2,2-dimethylpropylamino)methyl]quinoline-6-carbonitrile Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-3-[(neopentylamino)methyl]quinoline-6-carbonitrile Formula: C24H27ClN4O MolecularWeight: 422.95038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNCC1=CN=C2C=CC(=CC2=C1NCC3=CC(=C(C=C3)OC)Cl)C#N

Isomeric SMILES

CC(C)(C)CNCC1=CN=C2C=CC(=CC2=C1NCC3=CC(=C(C=C3)OC)Cl)C#N

InChI

InChI=1S/C24H27ClN4O/c1-24(2,3)15-27-13-18-14-28-21-7-5-16(11-26)9-19(21)23(18)29-12-17-6-8-22(30-4)20(25)10-17/h5-10,14,27H,12-13,15H2,1-4H3,(H,28,29)