ethyl (3R)-1-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3R)-1-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-1-[(7-methoxy-2-oxo-chromen-4-yl)methyl]piperidin-1-ium-3-carboxylate CAS Name: (3R)-1-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-[(7-methoxy-2-oxochromen-4-yl)methyl]piperidin-1-ium-3-carboxylate Traditional Name: (3R)-1-[(2-keto-7-methoxy-chromen-4-yl)methyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C19H24NO5+ MolecularWeight: 346.39756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CCOC(=O)[C@@H]1CCC[NH+](C1)CC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C19H23NO5/c1-3-24-19(22)13-5-4-8-20(11-13)12-14-9-18(21)25-17-10-15(23-2)6-7-16(14)17/h6-7,9-10,13H,3-5,8,11-12H2,1-2H3/p+1/t13-/m1/s1