N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]-4-nitro-benzamide

Systemtic Name: N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]-4-nitro-benzamide Openeye Name: N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]-4-nitro-benzamide CAS Name: N-[1-(2-methyl-1-oxopropyl)-3,4-dihydro-2H-quinolin-7-yl]-4-nitrobenzamide IUPAC Name: N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]-4-nitrobenzamide Traditional Name: N-(1-isobutyryl-3,4-dihydro-2H-quinolin-7-yl)-4-nitro-benzamide Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O4/c1-13(2)20(25)22-11-3-4-14-5-8-16(12-18(14)22)21-19(24)15-6-9-17(10-7-15)23(26)27/h5-10,12-13H,3-4,11H2,1-2H3,(H,21,24)