(2S,3S)-1-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-2-phenyl-piperidin-3-amine

Systemtic Name: (2S,3S)-1-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-2-phenyl-piperidin-3-amine Openeye Name: (2S,3S)-1-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-2-phenyl-piperidin-3-amine CAS Name: (2S,3S)-1-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-2-phenyl-3-piperidinamine IUPAC Name: (2S,3S)-1-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-2-phenylpiperidin-3-amine Traditional Name: [(2S,3S)-1-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-2-phenyl-3-piperidyl]amine Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)OCCO2)CN3CCCC(C3C4=CC=CC=C4)N

Isomeric SMILES

COC1=C(C2=C(C=C1)OCCO2)CN3CCC[C@@H]([C@@H]3C4=CC=CC=C4)N

InChI

InChI=1S/C21H26N2O3/c1-24-18-9-10-19-21(26-13-12-25-19)16(18)14-23-11-5-8-17(22)20(23)15-6-3-2-4-7-15/h2-4,6-7,9-10,17,20H,5,8,11-14,22H2,1H3/t17-,20-/m0/s1