1-hexyl-3-methoxy-indole-2-carboxylic acid

Systemtic Name: 1-hexyl-3-methoxy-indole-2-carboxylic acid Openeye Name: 1-hexyl-3-methoxy-indole-2-carboxylic acid CAS Name: 1-hexyl-3-methoxy-2-indolecarboxylic acid IUPAC Name: 1-hexyl-3-methoxyindole-2-carboxylic acid Traditional Name: 1-hexyl-3-methoxy-indole-2-carboxylic acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2C(=C1C(=O)O)OC

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(=C1C(=O)O)OC

InChI

InChI=1S/C16H21NO3/c1-3-4-5-8-11-17-13-10-7-6-9-12(13)15(20-2)14(17)16(18)19/h6-7,9-10H,3-5,8,11H2,1-2H3,(H,18,19)