(3R)-1-[2-(6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoyl]piperidine-3-carboxylic acid

Systemtic Name: (3R)-1-[2-(6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoyl]piperidine-3-carboxylic acid Openeye Name: (3R)-1-[2-(6-chloro-4-methyl-2-oxo-chromen-7-yl)oxyacetyl]piperidine-3-carboxylic acid CAS Name: (3R)-1-[2-[(6-chloro-4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: (3R)-1-[2-(6-chloro-4-methyl-2-oxochromen-7-yl)oxyacetyl]piperidine-3-carboxylic acid Traditional Name: (3R)-1-[2-(6-chloro-2-keto-4-methyl-chromen-7-yl)oxyacetyl]nipecotic acid Formula: C18H18ClNO6 MolecularWeight: 379.79162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCCC(C3)C(=O)O

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCC[C@H](C3)C(=O)O

InChI

InChI=1S/C18H18ClNO6/c1-10-5-17(22)26-14-7-15(13(19)6-12(10)14)25-9-16(21)20-4-2-3-11(8-20)18(23)24/h5-7,11H,2-4,8-9H2,1H3,(H,23,24)/t11-/m1/s1