1'-methyl-4-oxidanylidene-spiro[3H-chromene-2,4'-piperidin-1-ium]-6-carboxylate

Systemtic Name: 1'-methyl-4-oxidanylidene-spiro[3H-chromene-2,4'-piperidin-1-ium]-6-carboxylate Openeye Name: 1'-methyl-4-oxo-spiro[chromane-2,4'-piperidin-1-ium]-6-carboxylate CAS Name: 1'-methyl-4-oxo-6-spiro[3,4-dihydro-2H-1-benzopyran-2,4'-piperidin-1-ium]carboxylate IUPAC Name: 1'-methyl-4-oxospiro[3H-chromene-2,4'-piperidin-1-ium]-6-carboxylate Traditional Name: 4-keto-1'-methyl-spiro[chroman-2,4'-piperidin-1-ium]-6-carboxylate Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2(CC1)CC(=O)C3=C(O2)C=CC(=C3)C(=O)[O-]

Isomeric SMILES

C[NH+]1CCC2(CC1)CC(=O)C3=C(O2)C=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C15H17NO4/c1-16-6-4-15(5-7-16)9-12(17)11-8-10(14(18)19)2-3-13(11)20-15/h2-3,8H,4-7,9H2,1H3,(H,18,19)