7-[[1-(3-aminophenyl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide trihydrochloride

Systemtic Name: 7-[[1-(3-aminophenyl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide trihydrochloride Openeye Name: 7-[[1-(3-aminophenyl)-4-piperidyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxamidine trihydrochloride CAS Name: 7-[[1-(3-aminophenyl)-4-piperidinyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide trihydrochloride IUPAC Name: 7-[[1-(3-aminophenyl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide trihydrochloride Traditional Name: 7-[[1-(3-aminophenyl)-4-piperidyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxamidine trihydrochloride Formula: C22H32Cl3N5O MolecularWeight: 488.88138

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1COC2=CC3=C(CCN(C3)C(=N)N)C=C2)C4=CC(=CC=C4)N.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCC1COC2=CC3=C(CCN(C3)C(=N)N)C=C2)C4=CC(=CC=C4)N.Cl.Cl.Cl

InChI

InChI=1S/C22H29N5O.3ClH/c23-19-2-1-3-20(13-19)26-9-6-16(7-10-26)15-28-21-5-4-17-8-11-27(22(24)25)14-18(17)12-21;;;/h1-5,12-13,16H,6-11,14-15,23H2,(H3,24,25);3*1H