4-chloranyl-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-3-nitro-benzamide CAS Name: 4-chloro-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(1-mesyl-3,4-dihydro-2H-quinolin-6-yl)-3-nitro-benzamide Formula: C17H16ClN3O5S MolecularWeight: 409.84404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3O5S/c1-27(25,26)20-8-2-3-11-9-13(5-7-15(11)20)19-17(22)12-4-6-14(18)16(10-12)21(23)24/h4-7,9-10H,2-3,8H2,1H3,(H,19,22)