N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-2-methyl-3-nitro-benzamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCS(=O)(=O)N2CCCC3=CC=CC=C32

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCS(=O)(=O)N2CCCC3=CC=CC=C32

InChI

InChI=1S/C19H21N3O5S/c1-14-16(8-4-10-17(14)22(24)25)19(23)20-11-13-28(26,27)21-12-5-7-15-6-2-3-9-18(15)21/h2-4,6,8-10H,5,7,11-13H2,1H3,(H,20,23)