[(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-[(4-sulfamoylphenyl)methyl]azanium

Systemtic Name: [(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-[(4-sulfamoylphenyl)methyl]azanium Openeye Name: [(1S)-2-(2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl]-[(4-sulfamoylphenyl)methyl]ammonium CAS Name: [(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]-[(4-sulfamoylphenyl)methyl]ammonium IUPAC Name: [(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]-[(4-sulfamoylphenyl)methyl]azanium Traditional Name: [(1S)-2-keto-2-(2-methoxy-5-methyl-anilino)-1-phenyl-ethyl]-(4-sulfamoylbenzyl)ammonium Formula: C23H26N3O4S+ MolecularWeight: 440.53524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C2=CC=CC=C2)[NH2+]CC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C2=CC=CC=C2)[NH2+]CC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C23H25N3O4S/c1-16-8-13-21(30-2)20(14-16)26-23(27)22(18-6-4-3-5-7-18)25-15-17-9-11-19(12-10-17)31(24,28)29/h3-14,22,25H,15H2,1-2H3,(H,26,27)(H2,24,28,29)/p+1/t22-/m0/s1