(3R)-1-[2-(2-oxidanylidenechromen-7-yl)oxyethanoyl]piperidine-3-carboxylic acid

Systemtic Name: (3R)-1-[2-(2-oxidanylidenechromen-7-yl)oxyethanoyl]piperidine-3-carboxylic acid Openeye Name: (3R)-1-[2-(2-oxochromen-7-yl)oxyacetyl]piperidine-3-carboxylic acid CAS Name: (3R)-1-[1-oxo-2-[(2-oxo-1-benzopyran-7-yl)oxy]ethyl]-3-piperidinecarboxylic acid IUPAC Name: (3R)-1-[2-(2-oxochromen-7-yl)oxyacetyl]piperidine-3-carboxylic acid Traditional Name: (3R)-1-[2-(2-ketochromen-7-yl)oxyacetyl]nipecotic acid Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)COC2=CC3=C(C=C2)C=CC(=O)O3)C(=O)O

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)COC2=CC3=C(C=C2)C=CC(=O)O3)C(=O)O

InChI

InChI=1S/C17H17NO6/c19-15(18-7-1-2-12(9-18)17(21)22)10-23-13-5-3-11-4-6-16(20)24-14(11)8-13/h3-6,8,12H,1-2,7,9-10H2,(H,21,22)/t12-/m1/s1