[2-[(4-carboxy-3-oxidanyl-phenyl)amino]-2-oxidanylidene-ethyl]-dimethyl-[3-(2-methylprop-2-enoylamino)propyl]azanium

Systemtic Name: [2-[(4-carboxy-3-oxidanyl-phenyl)amino]-2-oxidanylidene-ethyl]-dimethyl-[3-(2-methylprop-2-enoylamino)propyl]azanium Openeye Name: [2-(4-carboxy-3-hydroxy-anilino)-2-oxo-ethyl]-dimethyl-[3-(2-methylprop-2-enoylamino)propyl]ammonium CAS Name: [2-(4-carboxy-3-hydroxyanilino)-2-oxoethyl]-dimethyl-[3-[(2-methyl-1-oxoprop-2-enyl)amino]propyl]ammonium IUPAC Name: [2-(4-carboxy-3-hydroxyanilino)-2-oxoethyl]-dimethyl-[3-(2-methylprop-2-enoylamino)propyl]azanium Traditional Name: [2-(4-carboxy-3-hydroxy-anilino)-2-keto-ethyl]-(3-methacrylamidopropyl)-dimethyl-ammonium Formula: C18H26N3O5+ MolecularWeight: 364.41614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)NCCC[N+](C)(C)CC(=O)NC1=CC(=C(C=C1)C(=O)O)O

Isomeric SMILES

CC(=C)C(=O)NCCC[N+](C)(C)CC(=O)NC1=CC(=C(C=C1)C(=O)O)O

InChI

InChI=1S/C18H25N3O5/c1-12(2)17(24)19-8-5-9-21(3,4)11-16(23)20-13-6-7-14(18(25)26)15(22)10-13/h6-7,10H,1,5,8-9,11H2,2-4H3,(H3-,19,20,22,23,24,25,26)/p+1