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

Systemtic Name: N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-6-yl]-2-nitro-benzamide Openeye Name: N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-6-yl]-2-nitro-benzamide CAS Name: N-[1-(2-methyl-1-oxopropyl)-3,4-dihydro-2H-quinolin-6-yl]-2-nitrobenzamide IUPAC Name: N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-6-yl]-2-nitrobenzamide Traditional Name: N-(1-isobutyryl-3,4-dihydro-2H-quinolin-6-yl)-2-nitro-benzamide Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O4/c1-13(2)20(25)22-11-5-6-14-12-15(9-10-17(14)22)21-19(24)16-7-3-4-8-18(16)23(26)27/h3-4,7-10,12-13H,5-6,11H2,1-2H3,(H,21,24)