ethyl 1-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(6-methyl-4-oxo-chromen-3-yl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(6-methyl-4-oxo-1-benzopyran-3-yl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(6-methyl-4-oxochromen-3-yl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(4-keto-6-methyl-chromen-3-yl)methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C19H24NO4+ MolecularWeight: 330.39816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=COC3=C(C2=O)C=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=COC3=C(C2=O)C=C(C=C3)C

InChI

InChI=1S/C19H23NO4/c1-3-23-19(22)14-6-8-20(9-7-14)11-15-12-24-17-5-4-13(2)10-16(17)18(15)21/h4-5,10,12,14H,3,6-9,11H2,1-2H3/p+1