3-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-2-oxidanylidene-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 3-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-2-oxidanylidene-1,3-benzoxazole-5-sulfonamide Openeye Name: 3-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-2-oxo-1,3-benzoxazole-5-sulfonamide CAS Name: 3-methyl-N-[4-(4-morpholin-4-iumylmethyl)phenyl]-2-oxo-1,3-benzoxazole-5-sulfonamide IUPAC Name: 3-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-2-oxo-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-keto-3-methyl-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-1,3-benzoxazole-5-sulfonamide Formula: C19H22N3O5S+ MolecularWeight: 404.46008

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)C[NH+]4CCOCC4)OC1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)C[NH+]4CCOCC4)OC1=O

InChI

InChI=1S/C19H21N3O5S/c1-21-17-12-16(6-7-18(17)27-19(21)23)28(24,25)20-15-4-2-14(3-5-15)13-22-8-10-26-11-9-22/h2-7,12,20H,8-11,13H2,1H3/p+1