3-(hydroxymethyl)-5-methyl-2-pentyl-1-phenethyl-indole-6-carboxylic acid

Systemtic Name: 3-(hydroxymethyl)-5-methyl-2-pentyl-1-phenethyl-indole-6-carboxylic acid Openeye Name: 3-(hydroxymethyl)-5-methyl-2-pentyl-1-phenethyl-indole-6-carboxylic acid CAS Name: 3-(hydroxymethyl)-5-methyl-2-pentyl-1-phenethyl-6-indolecarboxylic acid IUPAC Name: 3-(hydroxymethyl)-5-methyl-2-pentyl-1-phenethylindole-6-carboxylic acid Traditional Name: 2-amyl-5-methyl-3-methylol-1-phenethyl-indole-6-carboxylic acid Formula: C24H29NO3 MolecularWeight: 379.49196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C2=CC(=C(C=C2N1CCC3=CC=CC=C3)C(=O)O)C)CO

Isomeric SMILES

CCCCCC1=C(C2=CC(=C(C=C2N1CCC3=CC=CC=C3)C(=O)O)C)CO

InChI

InChI=1S/C24H29NO3/c1-3-4-6-11-22-21(16-26)20-14-17(2)19(24(27)28)15-23(20)25(22)13-12-18-9-7-5-8-10-18/h5,7-10,14-15,26H,3-4,6,11-13,16H2,1-2H3,(H,27,28)