(2S,3S)-N-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-2-phenyl-pyrrolidin-3-amine

Systemtic Name: (2S,3S)-N-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-2-phenyl-pyrrolidin-3-amine Openeye Name: (2S,3S)-N-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-2-phenyl-pyrrolidin-3-amine CAS Name: (2S,3S)-N-[(2-bromo-4,5-dimethoxyphenyl)methyl]-2-phenyl-3-pyrrolidinamine IUPAC Name: (2S,3S)-N-[(2-bromo-4,5-dimethoxyphenyl)methyl]-2-phenylpyrrolidin-3-amine Traditional Name: (2-bromo-4,5-dimethoxy-benzyl)-[(2S,3S)-2-phenylpyrrolidin-3-yl]amine Formula: C19H23BrN2O2 MolecularWeight: 391.30212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CNC2CCNC2C3=CC=CC=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CN[C@H]2CCN[C@H]2C3=CC=CC=C3)Br)OC

InChI

InChI=1S/C19H23BrN2O2/c1-23-17-10-14(15(20)11-18(17)24-2)12-22-16-8-9-21-19(16)13-6-4-3-5-7-13/h3-7,10-11,16,19,21-22H,8-9,12H2,1-2H3/t16-,19-/m0/s1