(1-oxidanylidene-3,4-dihydroisoquinolin-2-yl)-[2-(4-sulfamoylphenyl)ethyl]carbamic acid

Systemtic Name: (1-oxidanylidene-3,4-dihydroisoquinolin-2-yl)-[2-(4-sulfamoylphenyl)ethyl]carbamic acid Openeye Name: (1-oxo-3,4-dihydroisoquinolin-2-yl)-[2-(4-sulfamoylphenyl)ethyl]carbamic acid CAS Name: (1-oxo-3,4-dihydroisoquinolin-2-yl)-[2-(4-sulfamoylphenyl)ethyl]carbamic acid IUPAC Name: (1-oxo-3,4-dihydroisoquinolin-2-yl)-[2-(4-sulfamoylphenyl)ethyl]carbamic acid Traditional Name: (1-keto-3,4-dihydroisoquinolin-2-yl)-[2-(4-sulfamoylphenyl)ethyl]carbamic acid Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=CC=CC=C21)N(CCC3=CC=C(C=C3)S(=O)(=O)N)C(=O)O

Isomeric SMILES

C1CN(C(=O)C2=CC=CC=C21)N(CCC3=CC=C(C=C3)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C18H19N3O5S/c19-27(25,26)15-7-5-13(6-8-15)9-11-21(18(23)24)20-12-10-14-3-1-2-4-16(14)17(20)22/h1-8H,9-12H2,(H,23,24)(H2,19,25,26)