5-bromanylpyridine-3-carboxylic acid; 5-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

Systemtic Name: 5-bromanylpyridine-3-carboxylic acid; 5-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine Openeye Name: 5-bromopyridine-3-carboxylic acid; 5-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine CAS Name: 5-bromo-3-pyridinecarboxylic acid; 5-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine IUPAC Name: 5-bromopyridine-3-carboxylic acid; 5-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine Traditional Name: 5-bromonicotinic acid; (5-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)amine Formula: C19H18BrN3O2 MolecularWeight: 400.26912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C3CCCC3=C2N.C1=C(C=NC=C1Br)C(=O)O

Isomeric SMILES

CC1=CC=CC2=C1N=C3CCCC3=C2N.C1=C(C=NC=C1Br)C(=O)O

InChI

InChI=1S/C13H14N2.C6H4BrNO2/c1-8-4-2-6-10-12(14)9-5-3-7-11(9)15-13(8)10;7-5-1-4(6(9)10)2-8-3-5/h2,4,6H,3,5,7H2,1H3,(H2,14,15);1-3H,(H,9,10)