4-[1-(phenylmethyl)pyrrol-2-yl]butanoic acid

Systemtic Name: 4-[1-(phenylmethyl)pyrrol-2-yl]butanoic acid Openeye Name: 4-(1-benzylpyrrol-2-yl)butanoic acid CAS Name: 4-[1-(phenylmethyl)-2-pyrrolyl]butanoic acid IUPAC Name: 4-(1-benzylpyrrol-2-yl)butanoic acid Traditional Name: 4-(1-benzylpyrrol-2-yl)butyric acid Formula: C15H17NO2 MolecularWeight: 243.30098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC=C2CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC=C2CCCC(=O)O

InChI

InChI=1S/C15H17NO2/c17-15(18)10-4-8-14-9-5-11-16(14)12-13-6-2-1-3-7-13/h1-3,5-7,9,11H,4,8,10,12H2,(H,17,18)