4-[1-[(4-hydroxyphenyl)methyl]pyrrol-2-yl]-2,4-bis(oxidanylidene)butanoic acid

Systemtic Name: 4-[1-[(4-hydroxyphenyl)methyl]pyrrol-2-yl]-2,4-bis(oxidanylidene)butanoic acid Openeye Name: 4-[1-[(4-hydroxyphenyl)methyl]pyrrol-2-yl]-2,4-dioxo-butanoic acid CAS Name: 4-[1-[(4-hydroxyphenyl)methyl]-2-pyrrolyl]-2,4-dioxobutanoic acid IUPAC Name: 4-[1-[(4-hydroxyphenyl)methyl]pyrrol-2-yl]-2,4-dioxobutanoic acid Traditional Name: 4-[1-(4-hydroxybenzyl)pyrrol-2-yl]-2,4-diketo-butyric acid Formula: C15H13NO5 MolecularWeight: 287.26742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CN(C(=C1)C(=O)CC(=O)C(=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/h1-7,17H,8-9H2,(H,20,21)