(E)-4-[3-(1H-imidazol-5-yl)propoxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[3-(1H-imidazol-5-yl)propoxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3-(1H-imidazol-5-yl)propoxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[3-(1H-imidazol-5-yl)propoxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3-(1H-imidazol-5-yl)propoxy]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[3-(1H-imidazol-5-yl)propoxy]-4-keto-but-2-enoic acid Formula: C10H12N2O4 MolecularWeight: 224.21328

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CCCOC(=O)C=CC(=O)O

Isomeric SMILES

C1=C(NC=N1)CCCOC(=O)/C=C/C(=O)O

InChI

InChI=1S/C10H12N2O4/c13-9(14)3-4-10(15)16-5-1-2-8-6-11-7-12-8/h3-4,6-7H,1-2,5H2,(H,11,12)(H,13,14)/b4-3+