2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(1,1,1,2,3,3,3-²H?)propan-2-yl]pentanenitrile hydrochloride

CAS: 1216413-74-9

Formula: C26H37ClN2O4

SMILES: Cl.[2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])C(CCCNCCC1=CC(OC)=C(OC)C=C1)(C#N)C1=CC(OC)=C(OC)C=C1

IUPAC: 2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(1,1,1,2,3,3,3-²H?)propan-2-yl]pentanenitrile hydrochloride

InChI: InChI=1/C26H36N2O4.ClH/c1-19(2)26(18-27,21-9-11-23(30-4)25(17-21)32-6)13-7-14-28-15-12-20-8-10-22(29-3)24(16-20)31-5;/h8-11,16-17,19,28H,7,12-15H2,1-6H3;1H/i1D3,2D3,19D;

Composition: C (64.51%), H (6.25%), [2H] (2.91%), Cl (7.32%), N (5.79%), O (13.22%)

Molar Mass: 484.08

Atom Count: 70

Heavy Atom Count: 33