2-[3-[(Z)-N-[(4-bromanyl-1H-pyrrol-2-yl)carbonylamino]-C-methyl-carbonimidoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[(Z)-N-[(4-bromanyl-1H-pyrrol-2-yl)carbonylamino]-C-methyl-carbonimidoyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[(Z)-N-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-C-methyl-carbonimidoyl]phenoxy]acetic acid CAS Name: 2-[3-[(1Z)-1-[[(4-bromo-1H-pyrrol-2-yl)-oxomethyl]hydrazinylidene]ethyl]phenoxy]acetic acid IUPAC Name: 2-[3-[(Z)-N-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-C-methylcarbonimidoyl]phenoxy]acetic acid Traditional Name: 2-[3-[(Z)-N-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-C-methyl-carbonimidoyl]phenoxy]acetic acid Formula: C15H14BrN3O4 MolecularWeight: 380.19336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CN1)Br)C2=CC(=CC=C2)OCC(=O)O

Isomeric SMILES

C/C(=N/NC(=O)C1=CC(=CN1)Br)/C2=CC(=CC=C2)OCC(=O)O

InChI

InChI=1S/C15H14BrN3O4/c1-9(18-19-15(22)13-6-11(16)7-17-13)10-3-2-4-12(5-10)23-8-14(20)21/h2-7,17H,8H2,1H3,(H,19,22)(H,20,21)/b18-9-