N'-(2-pyrrolidin-1-ylethyl)-2,3-dihydro-1,4-benzodioxine-3-carboximidamide hydrate hydrochloride

Systemtic Name: N'-(2-pyrrolidin-1-ylethyl)-2,3-dihydro-1,4-benzodioxine-3-carboximidamide hydrate hydrochloride Openeye Name: N'-(2-pyrrolidin-1-ylethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamidine hydrate hydrochloride CAS Name: N'-[2-(1-pyrrolidinyl)ethyl]-2,3-dihydro-1,4-benzodioxin-3-carboximidamide hydrate hydrochloride IUPAC Name: N'-(2-pyrrolidin-1-ylethyl)-2,3-dihydro-1,4-benzodioxine-3-carboximidamide hydrate hydrochloride Traditional Name: N'-(2-pyrrolidinoethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamidine hydrate hydrochloride Formula: C15H24ClN3O3 MolecularWeight: 329.82236

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN=C(C2COC3=CC=CC=C3O2)N.O.Cl

Isomeric SMILES

C1CCN(C1)CCN=C(C2COC3=CC=CC=C3O2)N.O.Cl

InChI

InChI=1S/C15H21N3O2.ClH.H2O/c16-15(17-7-10-18-8-3-4-9-18)14-11-19-12-5-1-2-6-13(12)20-14;;/h1-2,5-6,14H,3-4,7-11H2,(H2,16,17);1H;1H2