1-[2-[4-[(2R)-2-acetamido-3-oxidanyl-3-oxidanylidene-propyl]phenoxy]ethyl]-3-dodecanoyl-indole-2-carboxylic acid

Systemtic Name: 1-[2-[4-[(2R)-2-acetamido-3-oxidanyl-3-oxidanylidene-propyl]phenoxy]ethyl]-3-dodecanoyl-indole-2-carboxylic acid Openeye Name: 1-[2-[4-[(2R)-2-acetamido-3-hydroxy-3-oxo-propyl]phenoxy]ethyl]-3-dodecanoyl-indole-2-carboxylic acid CAS Name: 1-[2-[4-[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]phenoxy]ethyl]-3-(1-oxododecyl)-2-indolecarboxylic acid IUPAC Name: 1-[2-[4-[(2R)-2-acetamido-3-hydroxy-3-oxopropyl]phenoxy]ethyl]-3-dodecanoylindole-2-carboxylic acid Traditional Name: 1-[2-[4-[(2R)-2-acetamido-3-hydroxy-3-keto-propyl]phenoxy]ethyl]-3-lauroyl-indole-2-carboxylic acid Formula: C34H44N2O7 MolecularWeight: 592.72236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(N(C2=CC=CC=C21)CCOC3=CC=C(C=C3)CC(C(=O)O)NC(=O)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(N(C2=CC=CC=C21)CCOC3=CC=C(C=C3)C[C@H](C(=O)O)NC(=O)C)C(=O)O

InChI

InChI=1S/C34H44N2O7/c1-3-4-5-6-7-8-9-10-11-16-30(38)31-27-14-12-13-15-29(27)36(32(31)34(41)42)21-22-43-26-19-17-25(18-20-26)23-28(33(39)40)35-24(2)37/h12-15,17-20,28H,3-11,16,21-23H2,1-2H3,(H,35,37)(H,39,40)(H,41,42)/t28-/m1/s1