N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1-pyrimidin-2-yl-piperidin-4-amine hydrochloride

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1-pyrimidin-2-yl-piperidin-4-amine hydrochloride Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1-pyrimidin-2-yl-piperidin-4-amine hydrochloride CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1-(2-pyrimidinyl)-4-piperidinamine hydrochloride IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine hydrochloride Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl-[1-(2-pyrimidyl)-4-piperidyl]amine hydrochloride Formula: C19H25ClN4O2 MolecularWeight: 376.8804

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC(=C2OC1)CNC3CCN(CC3)C4=NC=CC=N4.Cl

Isomeric SMILES

C1COC2=CC=CC(=C2OC1)CNC3CCN(CC3)C4=NC=CC=N4.Cl

InChI

InChI=1S/C19H24N4O2.ClH/c1-4-15(18-17(5-1)24-12-3-13-25-18)14-22-16-6-10-23(11-7-16)19-20-8-2-9-21-19;/h1-2,4-5,8-9,16,22H,3,6-7,10-14H2;1H