1-[2-[4-carboxy-2,6-bis(fluoranyl)phenoxy]ethyl]-3-dodecanoyl-indole-2-carboxylic acid

Systemtic Name: 1-[2-[4-carboxy-2,6-bis(fluoranyl)phenoxy]ethyl]-3-dodecanoyl-indole-2-carboxylic acid Openeye Name: 1-[2-(4-carboxy-2,6-difluoro-phenoxy)ethyl]-3-dodecanoyl-indole-2-carboxylic acid CAS Name: 1-[2-(4-carboxy-2,6-difluorophenoxy)ethyl]-3-(1-oxododecyl)-2-indolecarboxylic acid IUPAC Name: 1-[2-(4-carboxy-2,6-difluorophenoxy)ethyl]-3-dodecanoylindole-2-carboxylic acid Traditional Name: 1-[2-(4-carboxy-2,6-difluoro-phenoxy)ethyl]-3-lauroyl-indole-2-carboxylic acid Formula: C30H35F2NO6 MolecularWeight: 543.598806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(N(C2=CC=CC=C21)CCOC3=C(C=C(C=C3F)C(=O)O)F)C(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(N(C2=CC=CC=C21)CCOC3=C(C=C(C=C3F)C(=O)O)F)C(=O)O

InChI

InChI=1S/C30H35F2NO6/c1-2-3-4-5-6-7-8-9-10-15-25(34)26-21-13-11-12-14-24(21)33(27(26)30(37)38)16-17-39-28-22(31)18-20(29(35)36)19-23(28)32/h11-14,18-19H,2-10,15-17H2,1H3,(H,35,36)(H,37,38)