4-[[4-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-methyl-quinolin-7-yl]methoxy]benzene-1,2-dicarbonitrile

Systemtic Name: 4-[[4-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-methyl-quinolin-7-yl]methoxy]benzene-1,2-dicarbonitrile Openeye Name: 4-[[4-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-methyl-7-quinolyl]methoxy]phthalonitrile CAS Name: 4-[[4-[2-(hydroxymethyl)-1-pyrrolidinyl]-2-methyl-7-quinolinyl]methoxy]benzene-1,2-dicarbonitrile IUPAC Name: 4-[[4-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-methylquinolin-7-yl]methoxy]benzene-1,2-dicarbonitrile Traditional Name: 4-[[2-methyl-4-(2-methylolpyrrolidino)-7-quinolyl]methoxy]phthalonitrile Formula: C24H22N4O2 MolecularWeight: 398.45708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)COC3=CC(=C(C=C3)C#N)C#N)C(=C1)N4CCCC4CO

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)COC3=CC(=C(C=C3)C#N)C#N)C(=C1)N4CCCC4CO

InChI

InChI=1S/C24H22N4O2/c1-16-9-24(28-8-2-3-20(28)14-29)22-7-4-17(10-23(22)27-16)15-30-21-6-5-18(12-25)19(11-21)13-26/h4-7,9-11,20,29H,2-3,8,14-15H2,1H3