N-methyl-1-methylsulfonyl-N-[(2-nitrophenyl)methyl]-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-methyl-1-methylsulfonyl-N-[(2-nitrophenyl)methyl]-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-methyl-1-methylsulfonyl-N-[(2-nitrophenyl)methyl]-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-methyl-1-methylsulfonyl-N-[(2-nitrophenyl)methyl]-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-methyl-1-methylsulfonyl-N-[(2-nitrophenyl)methyl]-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-mesyl-N-methyl-N-(2-nitrobenzyl)-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

Isomeric SMILES

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

InChI

InChI=1S/C19H21N3O5S/c1-20(13-16-6-3-4-8-18(16)22(24)25)19(23)15-9-10-17-14(12-15)7-5-11-21(17)28(2,26)27/h3-4,6,8-10,12H,5,7,11,13H2,1-2H3