4-[azepan-4-yl-(2-methylquinolin-7-yl)oxy-methyl]benzenecarbonitrile hydrochloride

Systemtic Name: 4-[azepan-4-yl-(2-methylquinolin-7-yl)oxy-methyl]benzenecarbonitrile hydrochloride Openeye Name: 4-[azepan-4-yl-[(2-methyl-7-quinolyl)oxy]methyl]benzonitrile hydrochloride CAS Name: 4-[4-azepanyl-[(2-methyl-7-quinolinyl)oxy]methyl]benzonitrile hydrochloride IUPAC Name: 4-[azepan-4-yl-(2-methylquinolin-7-yl)oxymethyl]benzonitrile hydrochloride Traditional Name: 4-[azepan-4-yl-[(2-methyl-7-quinolyl)oxy]methyl]benzonitrile hydrochloride Formula: C24H26ClN3O MolecularWeight: 407.93574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=CC(=C2)OC(C3CCCNCC3)C4=CC=C(C=C4)C#N.Cl

Isomeric SMILES

CC1=NC2=C(C=C1)C=CC(=C2)OC(C3CCCNCC3)C4=CC=C(C=C4)C#N.Cl

InChI

InChI=1S/C24H25N3O.ClH/c1-17-4-7-19-10-11-22(15-23(19)27-17)28-24(20-3-2-13-26-14-12-20)21-8-5-18(16-25)6-9-21;/h4-11,15,20,24,26H,2-3,12-14H2,1H3;1H