4-chloranyl-N-[[5-(4-methoxy-3-methyl-phenyl)isoquinolin-8-yl]methyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[[5-(4-methoxy-3-methyl-phenyl)isoquinolin-8-yl]methyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[[5-(4-methoxy-3-methyl-phenyl)-8-isoquinolyl]methyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[[5-(4-methoxy-3-methylphenyl)-8-isoquinolinyl]methyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[[5-(4-methoxy-3-methylphenyl)isoquinolin-8-yl]methyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[[5-(4-methoxy-3-methyl-phenyl)-8-isoquinolyl]methyl]-3-nitro-benzenesulfonamide Formula: C24H20ClN3O5S MolecularWeight: 497.9507

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNS(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNS(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C24H20ClN3O5S/c1-15-11-16(4-8-24(15)33-2)19-6-3-17(21-14-26-10-9-20(19)21)13-27-34(31,32)18-5-7-22(25)23(12-18)28(29)30/h3-12,14,27H,13H2,1-2H3