3-(1-butyl-5-methyl-3,4-diphenyl-pyrrol-2-yl)propanoic acid

Systemtic Name: 3-(1-butyl-5-methyl-3,4-diphenyl-pyrrol-2-yl)propanoic acid Openeye Name: 3-(1-butyl-5-methyl-3,4-diphenyl-pyrrol-2-yl)propanoic acid CAS Name: 3-(1-butyl-5-methyl-3,4-diphenyl-2-pyrrolyl)propanoic acid IUPAC Name: 3-(1-butyl-5-methyl-3,4-diphenylpyrrol-2-yl)propanoic acid Traditional Name: 3-(1-butyl-5-methyl-3,4-diphenyl-pyrrol-2-yl)propionic acid Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=C1CCC(=O)O)C2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCCCN1C(=C(C(=C1CCC(=O)O)C2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C24H27NO2/c1-3-4-17-25-18(2)23(19-11-7-5-8-12-19)24(20-13-9-6-10-14-20)21(25)15-16-22(26)27/h5-14H,3-4,15-17H2,1-2H3,(H,26,27)