1-(4-phenylmethoxyphenyl)-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxy-propan-2-amine hydrochloride

Systemtic Name: 1-(4-phenylmethoxyphenyl)-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxy-propan-2-amine hydrochloride Openeye Name: 1-(4-benzyloxyphenyl)-3-[[5-[(E)-2-(4-pyridyl)vinyl]-3-pyridyl]oxy]propan-2-amine hydrochloride CAS Name: 1-(4-phenylmethoxyphenyl)-3-[[5-[(E)-2-pyridin-4-ylethenyl]-3-pyridinyl]oxy]-2-propanamine hydrochloride IUPAC Name: 1-(4-phenylmethoxyphenyl)-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxypropan-2-amine hydrochloride Traditional Name: [1-(4-benzoxybenzyl)-2-[[5-[(E)-2-(4-pyridyl)vinyl]-3-pyridyl]oxy]ethyl]amine hydrochloride Formula: C28H28ClN3O2 MolecularWeight: 473.99382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(COC3=CN=CC(=C3)C=CC4=CC=NC=C4)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(COC3=CN=CC(=C3)/C=C/C4=CC=NC=C4)N.Cl

InChI

InChI=1S/C28H27N3O2.ClH/c29-26(16-23-8-10-27(11-9-23)32-20-24-4-2-1-3-5-24)21-33-28-17-25(18-31-19-28)7-6-22-12-14-30-15-13-22;/h1-15,17-19,26H,16,20-21,29H2;1H/b7-6+;