4-[2-methyl-1-(4-oxidanyl-3-propan-2-yl-phenyl)carbonyl-indol-3-yl]butanoic acid

Systemtic Name: 4-[2-methyl-1-(4-oxidanyl-3-propan-2-yl-phenyl)carbonyl-indol-3-yl]butanoic acid Openeye Name: 4-[1-(4-hydroxy-3-isopropyl-benzoyl)-2-methyl-indol-3-yl]butanoic acid CAS Name: 4-[1-[(4-hydroxy-3-propan-2-ylphenyl)-oxomethyl]-2-methyl-3-indolyl]butanoic acid IUPAC Name: 4-[1-(4-hydroxy-3-propan-2-ylbenzoyl)-2-methylindol-3-yl]butanoic acid Traditional Name: 4-[1-(4-hydroxy-3-isopropyl-benzoyl)-2-methyl-indol-3-yl]butyric acid Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C(=O)C3=CC(=C(C=C3)O)C(C)C)CCCC(=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C(=O)C3=CC(=C(C=C3)O)C(C)C)CCCC(=O)O

InChI

InChI=1S/C23H25NO4/c1-14(2)19-13-16(11-12-21(19)25)23(28)24-15(3)17(8-6-10-22(26)27)18-7-4-5-9-20(18)24/h4-5,7,9,11-14,25H,6,8,10H2,1-3H3,(H,26,27)