2-(1-hexyl-2-methyl-4,5-diphenyl-pyrrol-3-yl)ethanoic acid

Systemtic Name: 2-(1-hexyl-2-methyl-4,5-diphenyl-pyrrol-3-yl)ethanoic acid Openeye Name: 2-(1-hexyl-2-methyl-4,5-diphenyl-pyrrol-3-yl)acetic acid CAS Name: 2-(1-hexyl-2-methyl-4,5-diphenyl-3-pyrrolyl)acetic acid IUPAC Name: 2-(1-hexyl-2-methyl-4,5-diphenylpyrrol-3-yl)acetic acid Traditional Name: 2-(1-hexyl-2-methyl-4,5-diphenyl-pyrrol-3-yl)acetic acid Formula: C25H29NO2 MolecularWeight: 375.50326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C(=C1C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)O)C

Isomeric SMILES

CCCCCCN1C(=C(C(=C1C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)O)C

InChI

InChI=1S/C25H29NO2/c1-3-4-5-12-17-26-19(2)22(18-23(27)28)24(20-13-8-6-9-14-20)25(26)21-15-10-7-11-16-21/h6-11,13-16H,3-5,12,17-18H2,1-2H3,(H,27,28)