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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(N(C(=C1C)CCC(=O)OC)CCCCCCC(=O)O)C

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(N(C(=C1C)CCC(=O)OC)CCCCCCC(=O)O)C

InChI

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