2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-4-[(phenylmethyl)amino]pyridine-3-carbonitrile dihydrochloride

Systemtic Name: 2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-4-[(phenylmethyl)amino]pyridine-3-carbonitrile dihydrochloride Openeye Name: 4-(benzylamino)-2-[2-hydroxy-3-(isopropylamino)propoxy]pyridine-3-carbonitrile dihydrochloride CAS Name: 2-[2-hydroxy-3-(propan-2-ylamino)propoxy]-4-[(phenylmethyl)amino]-3-pyridinecarbonitrile dihydrochloride IUPAC Name: 4-(benzylamino)-2-[2-hydroxy-3-(propan-2-ylamino)propoxy]pyridine-3-carbonitrile dihydrochloride Traditional Name: 4-(benzylamino)-2-[2-hydroxy-3-(isopropylamino)propoxy]nicotinonitrile dihydrochloride Formula: C19H26Cl2N4O2 MolecularWeight: 413.34134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=NC=CC(=C1C#N)NCC2=CC=CC=C2)O.Cl.Cl

Isomeric SMILES

CC(C)NCC(COC1=NC=CC(=C1C#N)NCC2=CC=CC=C2)O.Cl.Cl

InChI

InChI=1S/C19H24N4O2.2ClH/c1-14(2)22-12-16(24)13-25-19-17(10-20)18(8-9-21-19)23-11-15-6-4-3-5-7-15;;/h3-9,14,16,22,24H,11-13H2,1-2H3,(H,21,23);2*1H