(2Z,5E)-2-oxidanyl-4-oxidanylidene-6-[1-(phenylmethyl)pyrrol-2-yl]hexa-2,5-dienoic acid

Systemtic Name: (2Z,5E)-2-oxidanyl-4-oxidanylidene-6-[1-(phenylmethyl)pyrrol-2-yl]hexa-2,5-dienoic acid Openeye Name: (2Z,5E)-6-(1-benzylpyrrol-2-yl)-2-hydroxy-4-oxo-hexa-2,5-dienoic acid CAS Name: (2Z,5E)-2-hydroxy-4-oxo-6-[1-(phenylmethyl)-2-pyrrolyl]hexa-2,5-dienoic acid IUPAC Name: (2Z,5E)-6-(1-benzylpyrrol-2-yl)-2-hydroxy-4-oxohexa-2,5-dienoic acid Traditional Name: (2Z,5E)-6-(1-benzylpyrrol-2-yl)-2-hydroxy-4-keto-hexa-2,5-dienoic acid Formula: C17H15NO4 MolecularWeight: 297.3053

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC=C2C=CC(=O)C=C(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC=C2/C=C/C(=O)/C=C(/C(=O)O)\O

InChI

InChI=1S/C17H15NO4/c19-15(11-16(20)17(21)22)9-8-14-7-4-10-18(14)12-13-5-2-1-3-6-13/h1-11,20H,12H2,(H,21,22)/b9-8+,16-11-