2-[4-[(Z)-C-ethyl-N-(1H-pyrrol-2-ylcarbonylamino)carbonimidoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(Z)-C-ethyl-N-(1H-pyrrol-2-ylcarbonylamino)carbonimidoyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(Z)-C-ethyl-N-(1H-pyrrole-2-carbonylamino)carbonimidoyl]phenoxy]acetic acid CAS Name: 2-[4-[(1Z)-1-[[oxo(1H-pyrrol-2-yl)methyl]hydrazinylidene]propyl]phenoxy]acetic acid IUPAC Name: 2-[4-[(Z)-C-ethyl-N-(1H-pyrrole-2-carbonylamino)carbonimidoyl]phenoxy]acetic acid Traditional Name: 2-[4-[(Z)-C-ethyl-N-(1H-pyrrole-2-carbonylamino)carbonimidoyl]phenoxy]acetic acid Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)C1=CC=CN1)C2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O4/c1-2-13(18-19-16(22)14-4-3-9-17-14)11-5-7-12(8-6-11)23-10-15(20)21/h3-9,17H,2,10H2,1H3,(H,19,22)(H,20,21)/b18-13-