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

Systemtic Name: (2S)-N-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]butan-2-amine Openeye Name: (2S)-N-[(3-bromo-4,5-dimethoxy-phenyl)methyl]butan-2-amine CAS Name: (2S)-N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-2-butanamine IUPAC Name: (2S)-N-[(3-bromo-4,5-dimethoxyphenyl)methyl]butan-2-amine Traditional Name: (3-bromo-4,5-dimethoxy-benzyl)-[(1S)-1-methylpropyl]amine Formula: C13H20BrNO2 MolecularWeight: 302.2074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC1=CC(=C(C(=C1)Br)OC)OC

Isomeric SMILES

CC[C@H](C)NCC1=CC(=C(C(=C1)Br)OC)OC

InChI

InChI=1S/C13H20BrNO2/c1-5-9(2)15-8-10-6-11(14)13(17-4)12(7-10)16-3/h6-7,9,15H,5,8H2,1-4H3/t9-/m0/s1