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2-(3-dodecyl-1,5-dimethyl-4-octadecanoyl-pyrrol-2-yl)ethanoic acid

2-(3-dodecyl-1,5-dimethyl-4-octadecanoyl-pyrrol-2-yl)ethanoic acid

Systemtic Name:2-(3-dodecyl-1,5-dimethyl-4-octadecanoyl-pyrrol-2-yl)ethanoic acid
Openeye Name:2-(3-dodecyl-1,5-dimethyl-4-octadecanoyl-pyrrol-2-yl)acetic acid
CAS Name:2-[3-dodecyl-1,5-dimethyl-4-(1-oxooctadecyl)-2-pyrrolyl]acetic acid
IUPAC Name:2-(3-dodecyl-1,5-dimethyl-4-octadecanoylpyrrol-2-yl)acetic acid
Traditional Name:2-(3-lauryl-1,5-dimethyl-4-stearoyl-pyrrol-2-yl)acetic acid
Formula: C38H69NO3
MolecularWeight: 587.95936
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C1=C(N(C(=C1CCCCCCCCCCCC)CC(=O)O)C)C


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C1=C(N(C(=C1CCCCCCCCCCCC)CC(=O)O)C)C


InChI

InChI=1S/C38H69NO3/c1-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-36(40)38-33(3)39(4)35(32-37(41)42)34(38)30-28-26-24-22-16-14-12-10-8-6-2/h5-32H2,1-4H3,(H,41,42)


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