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

Systemtic Name: (E)-4-[1-[(4-aminophenyl)methyl]pyrrol-2-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[1-[(4-aminophenyl)methyl]pyrrol-2-yl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[1-[(4-aminophenyl)methyl]-2-pyrrolyl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[1-[(4-aminophenyl)methyl]pyrrol-2-yl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-[1-(4-aminobenzyl)pyrrol-2-yl]-4-hydroxy-2-keto-but-3-enoic acid Formula: C15H14N2O4 MolecularWeight: 286.28266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O4/c16-11-5-3-10(4-6-11)9-17-7-1-2-12(17)13(18)8-14(19)15(20)21/h1-8,18H,9,16H2,(H,20,21)/b13-8+