3-[1-(4-propan-2-ylphenyl)pyrrol-3-yl]benzoic acid

Systemtic Name: 3-[1-(4-propan-2-ylphenyl)pyrrol-3-yl]benzoic acid Openeye Name: 3-[1-(4-isopropylphenyl)pyrrol-3-yl]benzoic acid CAS Name: 3-[1-(4-propan-2-ylphenyl)-3-pyrrolyl]benzoic acid IUPAC Name: 3-[1-(4-propan-2-ylphenyl)pyrrol-3-yl]benzoic acid Traditional Name: 3-(1-p-cumenylpyrrol-3-yl)benzoic acid Formula: C20H19NO2 MolecularWeight: 305.37036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C=CC(=C2)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C=CC(=C2)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C20H19NO2/c1-14(2)15-6-8-19(9-7-15)21-11-10-18(13-21)16-4-3-5-17(12-16)20(22)23/h3-14H,1-2H3,(H,22,23)