2-methyl-5-nitro-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Openeye Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-methyl-5-nitro-benzenesulfonamide Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C23H21N3O5S/c1-16-7-10-21(26(28)29)14-22(16)32(30,31)24-20-9-8-17-11-12-25(15-19(17)13-20)23(27)18-5-3-2-4-6-18/h2-10,13-14,24H,11-12,15H2,1H3