(2-naphthalen-1-yloxyethylamino)azanium; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate

Systemtic Name: (2-naphthalen-1-yloxyethylamino)azanium; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate Openeye Name: (Z)-4-hydroxy-4-oxo-but-2-enoate; [2-(1-naphthyloxy)ethylamino]ammonium CAS Name: (Z)-4-hydroxy-4-oxo-2-butenoate; [2-(1-naphthalenyloxy)ethylamino]ammonium IUPAC Name: (Z)-4-hydroxy-4-oxobut-2-enoate; (2-naphthalen-1-yloxyethylamino)azanium Traditional Name: (Z)-4-hydroxy-4-keto-but-2-enoate; [2-(1-naphthoxy)ethylamino]ammonium Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OCCN[NH3+].C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OCCN[NH3+].C(=C\C(=O)[O-])\C(=O)O

InChI

InChI=1S/C12H14N2O.C4H4O4/c13-14-8-9-15-12-7-3-5-10-4-1-2-6-11(10)12;5-3(6)1-2-4(7)8/h1-7,14H,8-9,13H2;1-2H,(H,5,6)(H,7,8)/b;2-1-