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

Systemtic Name: (2S)-1-phenoxy-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxy-propan-2-amine Openeye Name: (2S)-1-phenoxy-3-[[5-[(E)-2-(4-pyridyl)vinyl]-3-pyridyl]oxy]propan-2-amine CAS Name: (2S)-1-phenoxy-3-[[5-[(E)-2-pyridin-4-ylethenyl]-3-pyridinyl]oxy]-2-propanamine IUPAC Name: (2S)-1-phenoxy-3-[5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxypropan-2-amine Traditional Name: [(1S)-1-(phenoxymethyl)-2-[[5-[(E)-2-(4-pyridyl)vinyl]-3-pyridyl]oxy]ethyl]amine Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(COC2=CN=CC(=C2)C=CC3=CC=NC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)OC[C@@H](COC2=CN=CC(=C2)/C=C/C3=CC=NC=C3)N

InChI

InChI=1S/C21H21N3O2/c22-19(15-25-20-4-2-1-3-5-20)16-26-21-12-18(13-24-14-21)7-6-17-8-10-23-11-9-17/h1-14,19H,15-16,22H2/b7-6+/t19-/m0/s1