1-[(1-ethyl-5-methoxy-indol-3-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(1-ethyl-5-methoxy-indol-3-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(1-ethyl-5-methoxy-indol-3-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(1-ethyl-5-methoxy-3-indolyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(1-ethyl-5-methoxyindol-3-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(1-ethyl-5-methoxy-indol-3-yl)methyl]isonipecotic acid Formula: C18H24N2O3 MolecularWeight: 316.39476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=C1C=CC(=C2)OC)CN3CCC(CC3)C(=O)O

Isomeric SMILES

CCN1C=C(C2=C1C=CC(=C2)OC)CN3CCC(CC3)C(=O)O

InChI

InChI=1S/C18H24N2O3/c1-3-20-12-14(16-10-15(23-2)4-5-17(16)20)11-19-8-6-13(7-9-19)18(21)22/h4-5,10,12-13H,3,6-9,11H2,1-2H3,(H,21,22)