2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-3-nitro-phenyl)benzamide

Systemtic Name: 2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-3-nitro-phenyl)benzamide Openeye Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-3-nitro-phenyl)benzamide CAS Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-3-nitrophenyl)benzamide IUPAC Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-3-nitrophenyl)benzamide Traditional Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-methyl-3-nitro-phenyl)benzamide Formula: C23H20ClN3O5S MolecularWeight: 485.94

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H20ClN3O5S/c1-15-6-7-18(12-22(15)27(29)30)25-23(28)20-13-19(8-9-21(20)24)33(31,32)26-11-10-16-4-2-3-5-17(16)14-26/h2-9,12-13H,10-11,14H2,1H3,(H,25,28)