(E)-4-[1-[(4-hydroxyphenyl)methyl]pyrrol-2-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[1-[(4-hydroxyphenyl)methyl]pyrrol-2-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-hydroxy-4-[1-[(4-hydroxyphenyl)methyl]pyrrol-2-yl]-2-oxo-but-3-enoic acid CAS Name: (E)-4-hydroxy-4-[1-[(4-hydroxyphenyl)methyl]-2-pyrrolyl]-2-oxo-3-butenoic acid IUPAC Name: (E)-4-hydroxy-4-[1-[(4-hydroxyphenyl)methyl]pyrrol-2-yl]-2-oxobut-3-enoic acid Traditional Name: (E)-4-hydroxy-4-[1-(4-hydroxybenzyl)pyrrol-2-yl]-2-keto-but-3-enoic acid Formula: C15H13NO5 MolecularWeight: 287.26742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C(=CC(=O)C(=O)O)O)CC2=CC=C(C=C2)O

Isomeric SMILES

C1=CN(C(=C1)/C(=C\C(=O)C(=O)O)/O)CC2=CC=C(C=C2)O

InChI

InChI=1S/C15H13NO5/c17-11-5-3-10(4-6-11)9-16-7-1-2-12(16)13(18)8-14(19)15(20)21/h1-8,17-18H,9H2,(H,20,21)/b13-8+