methyl 3-(1-ethyl-3,5-dimethyl-4-octadecanoyl-pyrrol-2-yl)propanoate

Systemtic Name: methyl 3-(1-ethyl-3,5-dimethyl-4-octadecanoyl-pyrrol-2-yl)propanoate Openeye Name: methyl 3-(1-ethyl-3,5-dimethyl-4-octadecanoyl-pyrrol-2-yl)propanoate CAS Name: 3-[1-ethyl-3,5-dimethyl-4-(1-oxooctadecyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-(1-ethyl-3,5-dimethyl-4-octadecanoylpyrrol-2-yl)propanoate Traditional Name: 3-(1-ethyl-3,5-dimethyl-4-stearoyl-pyrrol-2-yl)propionic acid methyl ester Formula: C30H53NO3 MolecularWeight: 475.74672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C1=C(N(C(=C1C)CCC(=O)OC)CC)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C1=C(N(C(=C1C)CCC(=O)OC)CC)C

InChI

InChI=1S/C30H53NO3/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28(32)30-25(3)27(23-24-29(33)34-5)31(7-2)26(30)4/h6-24H2,1-5H3