methyl-(2-phenoxyethylamino)azanium; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate

Systemtic Name: methyl-(2-phenoxyethylamino)azanium; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate Openeye Name: (Z)-4-hydroxy-4-oxo-but-2-enoate; methyl-(2-phenoxyethylamino)ammonium CAS Name: (Z)-4-hydroxy-4-oxo-2-butenoate; methyl-(2-phenoxyethylamino)ammonium IUPAC Name: (Z)-4-hydroxy-4-oxobut-2-enoate; methyl-(2-phenoxyethylamino)azanium Traditional Name: (Z)-4-hydroxy-4-keto-but-2-enoate; methyl-(2-phenoxyethylamino)ammonium Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]NCCOC1=CC=CC=C1.C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

C[NH2+]NCCOC1=CC=CC=C1.C(=C\C(=O)[O-])\C(=O)O

InChI

InChI=1S/C9H14N2O.C4H4O4/c1-10-11-7-8-12-9-5-3-2-4-6-9;5-3(6)1-2-4(7)8/h2-6,10-11H,7-8H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-