methyl N-[5-methoxy-2-oxidanyl-4-(2-pyridin-1-ium-1-ylethanoylamino)phenyl]carbamate

Systemtic Name: methyl N-[5-methoxy-2-oxidanyl-4-(2-pyridin-1-ium-1-ylethanoylamino)phenyl]carbamate Openeye Name: methyl N-[2-hydroxy-5-methoxy-4-[(2-pyridin-1-ium-1-ylacetyl)amino]phenyl]carbamate CAS Name: N-[2-hydroxy-5-methoxy-4-[[1-oxo-2-(1-pyridin-1-iumyl)ethyl]amino]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-hydroxy-5-methoxy-4-[(2-pyridin-1-ium-1-ylacetyl)amino]phenyl]carbamate Traditional Name: N-[2-hydroxy-5-methoxy-4-[(2-pyridin-1-ium-1-ylacetyl)amino]phenyl]carbamic acid methyl ester Formula: C16H18N3O5+ MolecularWeight: 332.33122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C[N+]2=CC=CC=C2)O)NC(=O)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C[N+]2=CC=CC=C2)O)NC(=O)OC

InChI

InChI=1S/C16H17N3O5/c1-23-14-9-11(18-16(22)24-2)13(20)8-12(14)17-15(21)10-19-6-4-3-5-7-19/h3-9H,10H2,1-2H3,(H2-,17,18,20,21,22)/p+1