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

Systemtic Name: 3-[1-(2,2-dimethylpropyl)-5-methanoyl-2,4-dimethyl-pyrrol-3-yl]propanoic acid Openeye Name: 3-[1-(2,2-dimethylpropyl)-5-formyl-2,4-dimethyl-pyrrol-3-yl]propanoic acid CAS Name: 3-[1-(2,2-dimethylpropyl)-5-formyl-2,4-dimethyl-3-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(2,2-dimethylpropyl)-5-formyl-2,4-dimethylpyrrol-3-yl]propanoic acid Traditional Name: 3-(5-formyl-2,4-dimethyl-1-neopentyl-pyrrol-3-yl)propionic acid Formula: C15H23NO3 MolecularWeight: 265.34802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1CCC(=O)O)C)CC(C)(C)C)C=O

Isomeric SMILES

CC1=C(N(C(=C1CCC(=O)O)C)CC(C)(C)C)C=O

InChI

InChI=1S/C15H23NO3/c1-10-12(6-7-14(18)19)11(2)16(13(10)8-17)9-15(3,4)5/h8H,6-7,9H2,1-5H3,(H,18,19)