azanyl 1-[1,4-bis(chloranyl)isoquinolin-7-yl]sulfonylcyclohexane-1-carboxylate

Systemtic Name: azanyl 1-[1,4-bis(chloranyl)isoquinolin-7-yl]sulfonylcyclohexane-1-carboxylate Openeye Name: amino 1-[(1,4-dichloro-7-isoquinolyl)sulfonyl]cyclohexanecarboxylate CAS Name: 1-[(1,4-dichloro-7-isoquinolinyl)sulfonyl]-1-cyclohexanecarboxylic acid amino ester IUPAC Name: amino 1-(1,4-dichloroisoquinolin-7-yl)sulfonylcyclohexane-1-carboxylate Traditional Name: 1-[(1,4-dichloro-7-isoquinolyl)sulfonyl]cyclohexanecarboxylic acid amino ester Formula: C16H16Cl2N2O4S MolecularWeight: 403.28024

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)ON)S(=O)(=O)C2=CC3=C(C=C2)C(=CN=C3Cl)Cl

Isomeric SMILES

C1CCC(CC1)(C(=O)ON)S(=O)(=O)C2=CC3=C(C=C2)C(=CN=C3Cl)Cl

InChI

InChI=1S/C16H16Cl2N2O4S/c17-13-9-20-14(18)12-8-10(4-5-11(12)13)25(22,23)16(15(21)24-19)6-2-1-3-7-16/h4-5,8-9H,1-3,6-7,19H2