4-[5-(8-methyl-5-propan-2-yl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid

Systemtic Name: 4-[5-(8-methyl-5-propan-2-yl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(5-isopropyl-8-methyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-(8-methyl-5-propan-2-yl-2H-1-benzopyran-3-yl)-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(8-methyl-5-propan-2-yl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(5-isopropyl-8-methyl-2H-chromen-3-yl)-1H-pyrrol-2-yl]benzoic acid Formula: C24H23NO3 MolecularWeight: 373.44432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C(C)C)C=C(CO2)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC1=C2C(=C(C=C1)C(C)C)C=C(CO2)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H23NO3/c1-14(2)19-9-4-15(3)23-20(19)12-18(13-28-23)22-11-10-21(25-22)16-5-7-17(8-6-16)24(26)27/h4-12,14,25H,13H2,1-3H3,(H,26,27)