butyl 4-(isoquinolin-5-ylsulfonylamino)benzoate

Systemtic Name: butyl 4-(isoquinolin-5-ylsulfonylamino)benzoate Openeye Name: butyl 4-(5-isoquinolylsulfonylamino)benzoate CAS Name: 4-(5-isoquinolinylsulfonylamino)benzoic acid butyl ester IUPAC Name: butyl 4-(isoquinolin-5-ylsulfonylamino)benzoate Traditional Name: 4-(5-isoquinolylsulfonylamino)benzoic acid butyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C20H20N2O4S/c1-2-3-13-26-20(23)15-7-9-17(10-8-15)22-27(24,25)19-6-4-5-16-14-21-12-11-18(16)19/h4-12,14,22H,2-3,13H2,1H3