4-[5-[5,6-di(propan-2-yl)pyrazin-2-yl]-1H-pyrrol-3-yl]benzoic acid

Systemtic Name: 4-[5-[5,6-di(propan-2-yl)pyrazin-2-yl]-1H-pyrrol-3-yl]benzoic acid Openeye Name: 4-[5-(5,6-diisopropylpyrazin-2-yl)-1H-pyrrol-3-yl]benzoic acid CAS Name: 4-[5-[5,6-di(propan-2-yl)-2-pyrazinyl]-1H-pyrrol-3-yl]benzoic acid IUPAC Name: 4-[5-[5,6-di(propan-2-yl)pyrazin-2-yl]-1H-pyrrol-3-yl]benzoic acid Traditional Name: 4-[5-(5,6-diisopropylpyrazin-2-yl)-1H-pyrrol-3-yl]benzoic acid Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC=C(N=C1C(C)C)C2=CC(=CN2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)C1=NC=C(N=C1C(C)C)C2=CC(=CN2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H23N3O2/c1-12(2)19-20(13(3)4)24-18(11-23-19)17-9-16(10-22-17)14-5-7-15(8-6-14)21(25)26/h5-13,22H,1-4H3,(H,25,26)