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

Systemtic Name: 7-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Openeye Name: 7-[[1-(2-pyridylmethyl)-4-piperidyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxamidine CAS Name: 7-[[1-(2-pyridinylmethyl)-4-piperidinyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide IUPAC Name: 7-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Traditional Name: 7-[[1-(2-pyridylmethyl)-4-piperidyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxamidine Formula: C22H29N5O MolecularWeight: 379.49856

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1COC2=CC3=C(CCN(C3)C(=N)N)C=C2)CC4=CC=CC=N4

Isomeric SMILES

C1CN(CCC1COC2=CC3=C(CCN(C3)C(=N)N)C=C2)CC4=CC=CC=N4

InChI

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