(Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate; (4-oxidanyl-1,2,3,4-tetrahydroacridin-9-yl)azanium

Systemtic Name: (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate; (4-oxidanyl-1,2,3,4-tetrahydroacridin-9-yl)azanium Openeye Name: (Z)-4-hydroxy-4-oxo-but-2-enoate; (4-hydroxy-1,2,3,4-tetrahydroacridin-9-yl)ammonium CAS Name: (Z)-4-hydroxy-4-oxo-2-butenoate; (4-hydroxy-1,2,3,4-tetrahydroacridin-9-yl)ammonium IUPAC Name: (Z)-4-hydroxy-4-oxobut-2-enoate; (4-hydroxy-1,2,3,4-tetrahydroacridin-9-yl)azanium Traditional Name: (Z)-4-hydroxy-4-keto-but-2-enoate; (4-hydroxy-1,2,3,4-tetrahydroacridin-9-yl)ammonium Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=NC3=CC=CC=C3C(=C2C1)[NH3+])O.C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

C1CC(C2=NC3=CC=CC=C3C(=C2C1)[NH3+])O.C(=C\C(=O)[O-])\C(=O)O

InChI

InChI=1S/C13H14N2O.C4H4O4/c14-12-8-4-1-2-6-10(8)15-13-9(12)5-3-7-11(13)16;5-3(6)1-2-4(7)8/h1-2,4,6,11,16H,3,5,7H2,(H2,14,15);1-2H,(H,5,6)(H,7,8)/b;2-1-