7-[4-dodecanoyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-3,5-dimethyl-pyrrol-1-yl]heptanoic acid

Systemtic Name: 7-[4-dodecanoyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-3,5-dimethyl-pyrrol-1-yl]heptanoic acid Openeye Name: 7-[4-dodecanoyl-2-(2-ethoxy-2-oxo-ethyl)-3,5-dimethyl-pyrrol-1-yl]heptanoic acid CAS Name: 7-[2-(2-ethoxy-2-oxoethyl)-3,5-dimethyl-4-(1-oxododecyl)-1-pyrrolyl]heptanoic acid IUPAC Name: 7-[4-dodecanoyl-2-(2-ethoxy-2-oxoethyl)-3,5-dimethylpyrrol-1-yl]heptanoic acid Traditional Name: 7-[2-(2-ethoxy-2-keto-ethyl)-4-lauroyl-3,5-dimethyl-pyrrol-1-yl]enanthic acid Formula: C29H49NO5 MolecularWeight: 491.70306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(N(C(=C1C)CC(=O)OCC)CCCCCCC(=O)O)C

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(N(C(=C1C)CC(=O)OCC)CCCCCCC(=O)O)C

InChI

InChI=1S/C29H49NO5/c1-5-7-8-9-10-11-12-13-16-19-26(31)29-23(3)25(22-28(34)35-6-2)30(24(29)4)21-18-15-14-17-20-27(32)33/h5-22H2,1-4H3,(H,32,33)