3-[1-[(4-fluorophenyl)methyl]-5-methanoyl-2,4-dimethyl-pyrrol-3-yl]propanoic acid

Systemtic Name: 3-[1-[(4-fluorophenyl)methyl]-5-methanoyl-2,4-dimethyl-pyrrol-3-yl]propanoic acid Openeye Name: 3-[1-[(4-fluorophenyl)methyl]-5-formyl-2,4-dimethyl-pyrrol-3-yl]propanoic acid CAS Name: 3-[1-[(4-fluorophenyl)methyl]-5-formyl-2,4-dimethyl-3-pyrrolyl]propanoic acid IUPAC Name: 3-[1-[(4-fluorophenyl)methyl]-5-formyl-2,4-dimethylpyrrol-3-yl]propanoic acid Traditional Name: 3-[1-(4-fluorobenzyl)-5-formyl-2,4-dimethyl-pyrrol-3-yl]propionic acid Formula: C17H18FNO3 MolecularWeight: 303.328123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1CCC(=O)O)C)CC2=CC=C(C=C2)F)C=O

Isomeric SMILES

CC1=C(N(C(=C1CCC(=O)O)C)CC2=CC=C(C=C2)F)C=O

InChI

InChI=1S/C17H18FNO3/c1-11-15(7-8-17(21)22)12(2)19(16(11)10-20)9-13-3-5-14(18)6-4-13/h3-6,10H,7-9H2,1-2H3,(H,21,22)