4-[azepan-4-yl-[2-(dimethylamino)-6-methyl-quinolin-7-yl]methoxy]benzenecarbonitrile

Systemtic Name: 4-[azepan-4-yl-[2-(dimethylamino)-6-methyl-quinolin-7-yl]methoxy]benzenecarbonitrile Openeye Name: 4-[azepan-4-yl-[2-(dimethylamino)-6-methyl-7-quinolyl]methoxy]benzonitrile CAS Name: 4-[4-azepanyl-[2-(dimethylamino)-6-methyl-7-quinolinyl]methoxy]benzonitrile IUPAC Name: 4-[azepan-4-yl-[2-(dimethylamino)-6-methylquinolin-7-yl]methoxy]benzonitrile Traditional Name: 4-[azepan-4-yl-[2-(dimethylamino)-6-methyl-7-quinolyl]methoxy]benzonitrile Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=CC(=N2)N(C)C)C(C3CCCNCC3)OC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C=C2C(=C1)C=CC(=N2)N(C)C)C(C3CCCNCC3)OC4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H30N4O/c1-18-15-21-8-11-25(30(2)3)29-24(21)16-23(18)26(20-5-4-13-28-14-12-20)31-22-9-6-19(17-27)7-10-22/h6-11,15-16,20,26,28H,4-5,12-14H2,1-3H3