1-[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl]piperidine-4-carboxylic acid CAS Name: 1-[2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl]isonipecotic acid Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC(=O)CN3CCC(CC3)C(=O)O)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=CC(=O)CN3CCC(CC3)C(=O)O)C)C

InChI

InChI=1S/C20H26N2O3/c1-20(2)16-6-4-5-7-17(16)21(3)18(20)12-15(23)13-22-10-8-14(9-11-22)19(24)25/h4-7,12,14H,8-11,13H2,1-3H3,(H,24,25)