2,3-dimethyl-1-pentyl-indole-5-carboxylate

Systemtic Name: 2,3-dimethyl-1-pentyl-indole-5-carboxylate Openeye Name: 2,3-dimethyl-1-pentyl-indole-5-carboxylate CAS Name: 2,3-dimethyl-1-pentyl-5-indolecarboxylate IUPAC Name: 2,3-dimethyl-1-pentylindole-5-carboxylate Traditional Name: 1-amyl-2,3-dimethyl-indole-5-carboxylate Formula: C16H20NO2- MolecularWeight: 258.3355

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C2=C1C=CC(=C2)C(=O)[O-])C)C

Isomeric SMILES

CCCCCN1C(=C(C2=C1C=CC(=C2)C(=O)[O-])C)C

InChI

InChI=1S/C16H21NO2/c1-4-5-6-9-17-12(3)11(2)14-10-13(16(18)19)7-8-15(14)17/h7-8,10H,4-6,9H2,1-3H3,(H,18,19)/p-1