1-[1-(5-methoxy-1H-indol-3-yl)-2-oxidanyl-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[1-(5-methoxy-1H-indol-3-yl)-2-oxidanyl-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-hydroxy-1-(5-methoxy-1H-indol-3-yl)-2-oxo-ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-hydroxy-1-(5-methoxy-1H-indol-3-yl)-2-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-hydroxy-1-(5-methoxy-1H-indol-3-yl)-2-oxoethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-hydroxy-2-keto-1-(5-methoxy-1H-indol-3-yl)ethyl]nipecotic acid Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCCC(C3)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C17H20N2O5/c1-24-11-4-5-14-12(7-11)13(8-18-14)15(17(22)23)19-6-2-3-10(9-19)16(20)21/h4-5,7-8,10,15,18H,2-3,6,9H2,1H3,(H,20,21)(H,22,23)