(1Z)-N-(2-oxidanyl-3-piperidin-1-yl-propoxy)isoquinoline-1-carboximidoyl chloride hydrochloride

Systemtic Name: (1Z)-N-(2-oxidanyl-3-piperidin-1-yl-propoxy)isoquinoline-1-carboximidoyl chloride hydrochloride Openeye Name: (1Z)-N-[2-hydroxy-3-(1-piperidyl)propoxy]isoquinoline-1-carboximidoyl chloride hydrochloride CAS Name: (1Z)-N-[2-hydroxy-3-(1-piperidinyl)propoxy]-1-isoquinolinecarboximidoyl chloride hydrochloride IUPAC Name: (1Z)-N-(2-hydroxy-3-piperidin-1-ylpropoxy)isoquinoline-1-carboximidoyl chloride hydrochloride Traditional Name: (1Z)-N-(2-hydroxy-3-piperidino-propoxy)isoquinoline-1-carboximidoyl chloride hydrochloride Formula: C18H23Cl2N3O2 MolecularWeight: 384.30012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CON=C(C2=NC=CC3=CC=CC=C32)Cl)O.Cl

Isomeric SMILES

C1CCN(CC1)CC(CO/N=C(/C2=NC=CC3=CC=CC=C32)\Cl)O.Cl

InChI

InChI=1S/C18H22ClN3O2.ClH/c19-18(17-16-7-3-2-6-14(16)8-9-20-17)21-24-13-15(23)12-22-10-4-1-5-11-22;/h2-3,6-9,15,23H,1,4-5,10-13H2;1H/b21-18-;