N-(phenylmethyl)-3-(4-pyridin-2-yl-3,4-dihydro-1H-isochromen-1-yl)propan-1-amine hydrochloride

Systemtic Name: N-(phenylmethyl)-3-(4-pyridin-2-yl-3,4-dihydro-1H-isochromen-1-yl)propan-1-amine hydrochloride Openeye Name: N-benzyl-3-[4-(2-pyridyl)isochroman-1-yl]propan-1-amine hydrochloride CAS Name: N-(phenylmethyl)-3-[4-(2-pyridinyl)-3,4-dihydro-1H-2-benzopyran-1-yl]-1-propanamine hydrochloride IUPAC Name: N-benzyl-3-(4-pyridin-2-yl-3,4-dihydro-1H-isochromen-1-yl)propan-1-amine hydrochloride Traditional Name: benzyl-[3-[4-(2-pyridyl)isochroman-1-yl]propyl]amine hydrochloride Formula: C24H27ClN2O MolecularWeight: 394.93698

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2C(O1)CCCNCC3=CC=CC=C3)C4=CC=CC=N4.Cl

Isomeric SMILES

C1C(C2=CC=CC=C2C(O1)CCCNCC3=CC=CC=C3)C4=CC=CC=N4.Cl

InChI

InChI=1S/C24H26N2O.ClH/c1-2-9-19(10-3-1)17-25-15-8-14-24-21-12-5-4-11-20(21)22(18-27-24)23-13-6-7-16-26-23;/h1-7,9-13,16,22,24-25H,8,14-15,17-18H2;1H