tert-butyl 2-[[1,4-bis(chloranyl)isoquinolin-7-yl]sulfonylamino]propanoate

Systemtic Name: tert-butyl 2-[[1,4-bis(chloranyl)isoquinolin-7-yl]sulfonylamino]propanoate Openeye Name: tert-butyl 2-[(1,4-dichloro-7-isoquinolyl)sulfonylamino]propanoate CAS Name: 2-[(1,4-dichloro-7-isoquinolinyl)sulfonylamino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(1,4-dichloroisoquinolin-7-yl)sulfonylamino]propanoate Traditional Name: 2-[(1,4-dichloro-7-isoquinolyl)sulfonylamino]propionic acid tert-butyl ester Formula: C16H18Cl2N2O4S MolecularWeight: 405.29612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC2=C(C=C1)C(=CN=C2Cl)Cl

Isomeric SMILES

CC(C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC2=C(C=C1)C(=CN=C2Cl)Cl

InChI

InChI=1S/C16H18Cl2N2O4S/c1-9(15(21)24-16(2,3)4)20-25(22,23)10-5-6-11-12(7-10)14(18)19-8-13(11)17/h5-9,20H,1-4H3