ethyl 1-ethyl-2-methyl-3-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]benzimidazol-1-ium-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-methyl-3-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]benzimidazol-1-ium-5-carboxylate Openeye Name: ethyl 1-ethyl-2-methyl-3-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]benzimidazol-1-ium-5-carboxylate CAS Name: 1-ethyl-2-methyl-3-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-5-benzimidazol-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-methyl-3-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]benzimidazol-1-ium-5-carboxylate Traditional Name: 1-ethyl-3-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]-2-methyl-benzimidazol-1-ium-5-carboxylic acid ethyl ester Formula: C19H23N4O4+ MolecularWeight: 371.41032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(N(C2=C1C=CC(=C2)C(=O)OCC)CC(=O)NC3=NOC(=C3)C)C

Isomeric SMILES

CC[N+]1=C(N(C2=C1C=CC(=C2)C(=O)OCC)CC(=O)NC3=NOC(=C3)C)C

InChI

InChI=1S/C19H22N4O4/c1-5-22-13(4)23(11-18(24)20-17-9-12(3)27-21-17)16-10-14(7-8-15(16)22)19(25)26-6-2/h7-10H,5-6,11H2,1-4H3/p+1