3-[1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-2-oxidanyl-2-oxidanylidene-ethyl]-1-methyl-indole-6-carboxylic acid

Systemtic Name: 3-[1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-2-oxidanyl-2-oxidanylidene-ethyl]-1-methyl-indole-6-carboxylic acid Openeye Name: 3-[1-[(3R,5S)-3,5-dimethyl-1-piperidyl]-2-hydroxy-2-oxo-ethyl]-1-methyl-indole-6-carboxylic acid CAS Name: 3-[1-[(3R,5S)-3,5-dimethyl-1-piperidinyl]-2-hydroxy-2-oxoethyl]-1-methyl-6-indolecarboxylic acid IUPAC Name: 3-[1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-2-hydroxy-2-oxoethyl]-1-methylindole-6-carboxylic acid Traditional Name: 3-[1-[(3R,5S)-3,5-dimethylpiperidino]-2-hydroxy-2-keto-ethyl]-1-methyl-indole-6-carboxylic acid Formula: C19H24N2O4 MolecularWeight: 344.40486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(C2=CN(C3=C2C=CC(=C3)C(=O)O)C)C(=O)O)C

Isomeric SMILES

C[C@@H]1C[C@@H](CN(C1)C(C2=CN(C3=C2C=CC(=C3)C(=O)O)C)C(=O)O)C

InChI

InChI=1S/C19H24N2O4/c1-11-6-12(2)9-21(8-11)17(19(24)25)15-10-20(3)16-7-13(18(22)23)4-5-14(15)16/h4-5,7,10-12,17H,6,8-9H2,1-3H3,(H,22,23)(H,24,25)/t11-,12+,17?