4-azanyl-3-bromanyl-5-[[cyclohexyl(methyl)amino]methyl]benzoic acid hydrochloride

Systemtic Name: 4-azanyl-3-bromanyl-5-[[cyclohexyl(methyl)amino]methyl]benzoic acid hydrochloride Openeye Name: 4-amino-3-bromo-5-[[cyclohexyl(methyl)amino]methyl]benzoic acid hydrochloride CAS Name: 4-amino-3-bromo-5-[[cyclohexyl(methyl)amino]methyl]benzoic acid hydrochloride IUPAC Name: 4-amino-3-bromo-5-[[cyclohexyl(methyl)amino]methyl]benzoic acid hydrochloride Traditional Name: 4-amino-3-bromo-5-[[cyclohexyl(methyl)amino]methyl]benzoic acid hydrochloride Formula: C15H22BrClN2O2 MolecularWeight: 377.70438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C(=CC(=C1)C(=O)O)Br)N)C2CCCCC2.Cl

Isomeric SMILES

CN(CC1=C(C(=CC(=C1)C(=O)O)Br)N)C2CCCCC2.Cl

InChI

InChI=1S/C15H21BrN2O2.ClH/c1-18(12-5-3-2-4-6-12)9-11-7-10(15(19)20)8-13(16)14(11)17;/h7-8,12H,2-6,9,17H2,1H3,(H,19,20);1H