4-[[4-[3-(cyclopropylmethoxy)pyrrolidin-1-yl]-2-methyl-quinolin-7-yl]oxymethyl]benzenecarbonitrile hydrochloride

Systemtic Name: 4-[[4-[3-(cyclopropylmethoxy)pyrrolidin-1-yl]-2-methyl-quinolin-7-yl]oxymethyl]benzenecarbonitrile hydrochloride Openeye Name: 4-[[4-[3-(cyclopropylmethoxy)pyrrolidin-1-yl]-2-methyl-7-quinolyl]oxymethyl]benzonitrile hydrochloride CAS Name: 4-[[4-[3-(cyclopropylmethoxy)-1-pyrrolidinyl]-2-methyl-7-quinolinyl]oxymethyl]benzonitrile hydrochloride IUPAC Name: 4-[[4-[3-(cyclopropylmethoxy)pyrrolidin-1-yl]-2-methylquinolin-7-yl]oxymethyl]benzonitrile hydrochloride Traditional Name: 4-[[4-[3-(cyclopropylmethoxy)pyrrolidino]-2-methyl-7-quinolyl]oxymethyl]benzonitrile hydrochloride Formula: C26H28ClN3O2 MolecularWeight: 449.97242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)OCC3=CC=C(C=C3)C#N)C(=C1)N4CCC(C4)OCC5CC5.Cl

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)OCC3=CC=C(C=C3)C#N)C(=C1)N4CCC(C4)OCC5CC5.Cl

InChI

InChI=1S/C26H27N3O2.ClH/c1-18-12-26(29-11-10-23(15-29)31-17-21-6-7-21)24-9-8-22(13-25(24)28-18)30-16-20-4-2-19(14-27)3-5-20;/h2-5,8-9,12-13,21,23H,6-7,10-11,15-17H2,1H3;1H