(1S)-1-(3-bromanyl-4-methoxy-phenyl)-N-butyl-N-methyl-ethane-1,2-diamine

Systemtic Name: (1S)-1-(3-bromanyl-4-methoxy-phenyl)-N-butyl-N-methyl-ethane-1,2-diamine Openeye Name: (1S)-1-(3-bromo-4-methoxy-phenyl)-N-butyl-N-methyl-ethane-1,2-diamine CAS Name: (1S)-1-(3-bromo-4-methoxyphenyl)-N-butyl-N-methylethane-1,2-diamine IUPAC Name: (1S)-1-(3-bromo-4-methoxyphenyl)-N-butyl-N-methylethane-1,2-diamine Traditional Name: [(1S)-2-amino-1-(3-bromo-4-methoxy-phenyl)ethyl]-butyl-methyl-amine Formula: C14H23BrN2O MolecularWeight: 315.24922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(CN)C1=CC(=C(C=C1)OC)Br

Isomeric SMILES

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

InChI

InChI=1S/C14H23BrN2O/c1-4-5-8-17(2)13(10-16)11-6-7-14(18-3)12(15)9-11/h6-7,9,13H,4-5,8,10,16H2,1-3H3/t13-/m1/s1