1-[4-(4-carboxyphenoxy)butyl]-3-dodecanoyl-indole-2-carboxylic acid

Systemtic Name: 1-[4-(4-carboxyphenoxy)butyl]-3-dodecanoyl-indole-2-carboxylic acid Openeye Name: 1-[4-(4-carboxyphenoxy)butyl]-3-dodecanoyl-indole-2-carboxylic acid CAS Name: 1-[4-(4-carboxyphenoxy)butyl]-3-(1-oxododecyl)-2-indolecarboxylic acid IUPAC Name: 1-[4-(4-carboxyphenoxy)butyl]-3-dodecanoylindole-2-carboxylic acid Traditional Name: 1-[4-(4-carboxyphenoxy)butyl]-3-lauroyl-indole-2-carboxylic acid Formula: C32H41NO6 MolecularWeight: 535.67104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(N(C2=CC=CC=C21)CCCCOC3=CC=C(C=C3)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(N(C2=CC=CC=C21)CCCCOC3=CC=C(C=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C32H41NO6/c1-2-3-4-5-6-7-8-9-10-17-28(34)29-26-15-11-12-16-27(26)33(30(29)32(37)38)22-13-14-23-39-25-20-18-24(19-21-25)31(35)36/h11-12,15-16,18-21H,2-10,13-14,17,22-23H2,1H3,(H,35,36)(H,37,38)