(7-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl-methyl-azanium; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate

Systemtic Name: (7-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl-methyl-azanium; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate Openeye Name: (Z)-4-hydroxy-4-oxo-but-2-enoate; (7-methoxy-2,3-dihydrobenzofuran-2-yl)methyl-methyl-ammonium CAS Name: (Z)-4-hydroxy-4-oxo-2-butenoate; (7-methoxy-2,3-dihydrobenzofuran-2-yl)methyl-methylammonium IUPAC Name: (Z)-4-hydroxy-4-oxobut-2-enoate; (7-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl-methylazanium Traditional Name: (Z)-4-hydroxy-4-keto-but-2-enoate; (7-methoxycoumaran-2-yl)methyl-methyl-ammonium Formula: C15H19NO6 MolecularWeight: 309.31446

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC1CC2=C(O1)C(=CC=C2)OC.C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

C[NH2+]CC1CC2=C(O1)C(=CC=C2)OC.C(=C\C(=O)[O-])\C(=O)O

InChI

InChI=1S/C11H15NO2.C4H4O4/c1-12-7-9-6-8-4-3-5-10(13-2)11(8)14-9;5-3(6)1-2-4(7)8/h3-5,9,12H,6-7H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-