1-heptyl-2,3-dimethyl-indole-5-carboxylic acid

Systemtic Name: 1-heptyl-2,3-dimethyl-indole-5-carboxylic acid Openeye Name: 1-heptyl-2,3-dimethyl-indole-5-carboxylic acid CAS Name: 1-heptyl-2,3-dimethyl-5-indolecarboxylic acid IUPAC Name: 1-heptyl-2,3-dimethylindole-5-carboxylic acid Traditional Name: 1-heptyl-2,3-dimethyl-indole-5-carboxylic acid Formula: C18H25NO2 MolecularWeight: 287.3966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=C(C2=C1C=CC(=C2)C(=O)O)C)C

Isomeric SMILES

CCCCCCCN1C(=C(C2=C1C=CC(=C2)C(=O)O)C)C

InChI

InChI=1S/C18H25NO2/c1-4-5-6-7-8-11-19-14(3)13(2)16-12-15(18(20)21)9-10-17(16)19/h9-10,12H,4-8,11H2,1-3H3,(H,20,21)