1-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-N-methyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-N-methyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl]-N-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C19H25N2O4+ MolecularWeight: 345.4128

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+]3CCC(CC3)C(=O)NC)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+]3CCC(CC3)C(=O)NC)O

InChI

InChI=1S/C19H24N2O4/c1-3-12-8-15-14(9-18(23)25-17(15)10-16(12)22)11-21-6-4-13(5-7-21)19(24)20-2/h8-10,13,22H,3-7,11H2,1-2H3,(H,20,24)/p+1