2-[2-(hydroxymethyl)-5-methanoyl-pyrrol-1-yl]-4-phenyl-butanoic acid

Systemtic Name: 2-[2-(hydroxymethyl)-5-methanoyl-pyrrol-1-yl]-4-phenyl-butanoic acid Openeye Name: 2-[2-formyl-5-(hydroxymethyl)pyrrol-1-yl]-4-phenyl-butanoic acid CAS Name: 2-[2-formyl-5-(hydroxymethyl)-1-pyrrolyl]-4-phenylbutanoic acid IUPAC Name: 2-[2-formyl-5-(hydroxymethyl)pyrrol-1-yl]-4-phenylbutanoic acid Traditional Name: 2-(2-formyl-5-methylol-pyrrol-1-yl)-4-phenyl-butyric acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)O)N2C(=CC=C2C=O)CO

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(=O)O)N2C(=CC=C2C=O)CO

InChI

InChI=1S/C16H17NO4/c18-10-13-7-8-14(11-19)17(13)15(16(20)21)9-6-12-4-2-1-3-5-12/h1-5,7-8,10,15,19H,6,9,11H2,(H,20,21)