N-[1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]-4-nitro-benzamide

Systemtic Name: N-[1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]-4-nitro-benzamide Openeye Name: 4-nitro-N-[1-(p-tolylsulfonyl)-3,4-dihydro-2H-quinolin-6-yl]benzamide CAS Name: N-[1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]-4-nitrobenzamide IUPAC Name: N-[1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]-4-nitrobenzamide Traditional Name: 4-nitro-N-(1-tosyl-3,4-dihydro-2H-quinolin-6-yl)benzamide Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC3=C2C=CC(=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC3=C2C=CC(=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O5S/c1-16-4-11-21(12-5-16)32(30,31)25-14-2-3-18-15-19(8-13-22(18)25)24-23(27)17-6-9-20(10-7-17)26(28)29/h4-13,15H,2-3,14H2,1H3,(H,24,27)