N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-4-nitro-benzamide

Systemtic Name: N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-4-nitro-benzamide Openeye Name: N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-4-nitro-benzamide CAS Name: N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-4-nitrobenzamide IUPAC Name: N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-4-nitrobenzamide Traditional Name: N-(1-mesyl-3,4-dihydro-2H-quinolin-7-yl)-4-nitro-benzamide Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5S/c1-26(24,25)19-10-2-3-12-4-7-14(11-16(12)19)18-17(21)13-5-8-15(9-6-13)20(22)23/h4-9,11H,2-3,10H2,1H3,(H,18,21)