1-(3,4-dihydro-2H-chromen-3-ylcarbonyl)piperidine-3-carboxylic acid

Systemtic Name: 1-(3,4-dihydro-2H-chromen-3-ylcarbonyl)piperidine-3-carboxylic acid Openeye Name: 1-(chromane-3-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[3,4-dihydro-2H-1-benzopyran-3-yl(oxo)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(3,4-dihydro-2H-chromene-3-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(chroman-3-carbonyl)nipecotic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2CC3=CC=CC=C3OC2)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)C2CC3=CC=CC=C3OC2)C(=O)O

InChI

InChI=1S/C16H19NO4/c18-15(17-7-3-5-12(9-17)16(19)20)13-8-11-4-1-2-6-14(11)21-10-13/h1-2,4,6,12-13H,3,5,7-10H2,(H,19,20)