6-[[3-[bromanyl(cyclopropyl)methoxy]phenyl]methyl-ethyl-amino]pyridine-3-carboxylic acid

Systemtic Name: 6-[[3-[bromanyl(cyclopropyl)methoxy]phenyl]methyl-ethyl-amino]pyridine-3-carboxylic acid Openeye Name: 6-[[3-[bromo(cyclopropyl)methoxy]phenyl]methyl-ethyl-amino]pyridine-3-carboxylic acid CAS Name: 6-[[3-[bromo(cyclopropyl)methoxy]phenyl]methyl-ethylamino]-3-pyridinecarboxylic acid IUPAC Name: 6-[[3-[bromo(cyclopropyl)methoxy]phenyl]methyl-ethylamino]pyridine-3-carboxylic acid Traditional Name: 6-[[3-[bromo(cyclopropyl)methoxy]benzyl]-ethyl-amino]nicotinic acid Formula: C19H21BrN2O3 MolecularWeight: 405.28564

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)OC(C2CC2)Br)C3=NC=C(C=C3)C(=O)O

Isomeric SMILES

CCN(CC1=CC(=CC=C1)OC(C2CC2)Br)C3=NC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H21BrN2O3/c1-2-22(17-9-8-15(11-21-17)19(23)24)12-13-4-3-5-16(10-13)25-18(20)14-6-7-14/h3-5,8-11,14,18H,2,6-7,12H2,1H3,(H,23,24)