1-[3-(2,4-dimethylpentan-3-ylcarbamoyl)-4-oxidanyl-phenoxy]-4,6-dimethyl-indole-2-carboxylic acid

Systemtic Name: 1-[3-(2,4-dimethylpentan-3-ylcarbamoyl)-4-oxidanyl-phenoxy]-4,6-dimethyl-indole-2-carboxylic acid Openeye Name: 1-[4-hydroxy-3-[(1-isopropyl-2-methyl-propyl)carbamoyl]phenoxy]-4,6-dimethyl-indole-2-carboxylic acid CAS Name: 1-[3-[(2,4-dimethylpentan-3-ylamino)-oxomethyl]-4-hydroxyphenoxy]-4,6-dimethyl-2-indolecarboxylic acid IUPAC Name: 1-[3-(2,4-dimethylpentan-3-ylcarbamoyl)-4-hydroxyphenoxy]-4,6-dimethylindole-2-carboxylic acid Traditional Name: 1-[4-hydroxy-3-[(1-isopropyl-2-methyl-propyl)carbamoyl]phenoxy]-4,6-dimethyl-indole-2-carboxylic acid Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(N(C2=C1)OC3=CC(=C(C=C3)O)C(=O)NC(C(C)C)C(C)C)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C=C(N(C2=C1)OC3=CC(=C(C=C3)O)C(=O)NC(C(C)C)C(C)C)C(=O)O)C

InChI

InChI=1S/C25H30N2O5/c1-13(2)23(14(3)4)26-24(29)19-11-17(7-8-22(19)28)32-27-20-10-15(5)9-16(6)18(20)12-21(27)25(30)31/h7-14,23,28H,1-6H3,(H,26,29)(H,30,31)