[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl] 5-(ethylsulfamoyl)-2-methyl-benzoate

Systemtic Name: [1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl] 5-(ethylsulfamoyl)-2-methyl-benzoate Openeye Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-methyl-2-oxo-ethyl] 5-(ethylsulfamoyl)-2-methyl-benzoate CAS Name: 5-(ethylsulfamoyl)-2-methylbenzoic acid [1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl] 5-(ethylsulfamoyl)-2-methylbenzoate Traditional Name: 5-(ethylsulfamoyl)-2-methyl-benzoic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-1-methyl-ethyl] ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)OC(C)C(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)OC(C)C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C22H26N2O5S/c1-4-23-30(27,28)19-10-9-15(2)20(13-19)22(26)29-16(3)21(25)24-12-11-17-7-5-6-8-18(17)14-24/h5-10,13,16,23H,4,11-12,14H2,1-3H3