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

Systemtic Name: 7-[(1-hexanimidoylpiperidin-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Openeye Name: 7-[(1-hexanimidoyl-4-piperidyl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxamidine CAS Name: 7-[[1-(1-iminohexyl)-4-piperidinyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide IUPAC Name: 7-[(1-hexanimidoylpiperidin-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Traditional Name: 7-[(1-hexanimidoyl-4-piperidyl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxamidine Formula: C22H35N5O MolecularWeight: 385.5462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=N)N1CCC(CC1)COC2=CC3=C(CCN(C3)C(=N)N)C=C2

Isomeric SMILES

CCCCCC(=N)N1CCC(CC1)COC2=CC3=C(CCN(C3)C(=N)N)C=C2

InChI

InChI=1S/C22H35N5O/c1-2-3-4-5-21(23)26-11-8-17(9-12-26)16-28-20-7-6-18-10-13-27(22(24)25)15-19(18)14-20/h6-7,14,17,23H,2-5,8-13,15-16H2,1H3,(H3,24,25)