1-[1-hexyl-4-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]ethanone

Systemtic Name: 1-[1-hexyl-4-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]ethanone Openeye Name: 1-[1-hexyl-4-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]ethanone CAS Name: 1-[1-hexyl-4-(4-methoxyphenyl)-2-methyl-3-pyrrolyl]ethanone IUPAC Name: 1-[1-hexyl-4-(4-methoxyphenyl)-2-methylpyrrol-3-yl]ethanone Traditional Name: 1-[1-hexyl-4-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]ethanone Formula: C20H27NO2 MolecularWeight: 313.43388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=C(C(=C1C)C(=O)C)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCN1C=C(C(=C1C)C(=O)C)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H27NO2/c1-5-6-7-8-13-21-14-19(20(15(21)2)16(3)22)17-9-11-18(23-4)12-10-17/h9-12,14H,5-8,13H2,1-4H3