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

Systemtic Name: 5-chloranyl-N-(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-2-nitro-benzamide Openeye Name: 5-chloro-N-(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-2-nitro-benzamide CAS Name: 5-chloro-N-(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-2-nitrobenzamide IUPAC Name: 5-chloro-N-(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-2-nitrobenzamide Traditional Name: 5-chloro-N-(1-esyl-3,4-dihydro-2H-quinolin-7-yl)-2-nitro-benzamide Formula: C18H18ClN3O5S MolecularWeight: 423.87062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3O5S/c1-2-28(26,27)21-9-3-4-12-5-7-14(11-17(12)21)20-18(23)15-10-13(19)6-8-16(15)22(24)25/h5-8,10-11H,2-4,9H2,1H3,(H,20,23)