4-[[3-[bromanyl(cyclopropyl)methoxy]phenyl]methyl-methyl-amino]pyridazine-3-carboxylic acid

Systemtic Name: 4-[[3-[bromanyl(cyclopropyl)methoxy]phenyl]methyl-methyl-amino]pyridazine-3-carboxylic acid Openeye Name: 4-[[3-[bromo(cyclopropyl)methoxy]phenyl]methyl-methyl-amino]pyridazine-3-carboxylic acid CAS Name: 4-[[3-[bromo(cyclopropyl)methoxy]phenyl]methyl-methylamino]-3-pyridazinecarboxylic acid IUPAC Name: 4-[[3-[bromo(cyclopropyl)methoxy]phenyl]methyl-methylamino]pyridazine-3-carboxylic acid Traditional Name: 4-[[3-[bromo(cyclopropyl)methoxy]benzyl]-methyl-amino]pyridazine-3-carboxylic acid Formula: C17H18BrN3O3 MolecularWeight: 392.24712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrN3O3/c1-21(14-7-8-19-20-15(14)17(22)23)10-11-3-2-4-13(9-11)24-16(18)12-5-6-12/h2-4,7-9,12,16H,5-6,10H2,1H3,(H,22,23)