1-[2-(3-ethanoylindol-1-yl)ethanoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-(3-ethanoylindol-1-yl)ethanoyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(3-acetylindol-1-yl)acetyl]piperidine-3-carboxylic acid CAS Name: 1-[2-(3-acetyl-1-indolyl)-1-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(3-acetylindol-1-yl)acetyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(3-acetylindol-1-yl)acetyl]nipecotic acid Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N3CCCC(C3)C(=O)O

Isomeric SMILES

CC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C18H20N2O4/c1-12(21)15-10-20(16-7-3-2-6-14(15)16)11-17(22)19-8-4-5-13(9-19)18(23)24/h2-3,6-7,10,13H,4-5,8-9,11H2,1H3,(H,23,24)