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

Systemtic Name: 2-methyl-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]-3-nitro-benzamide Openeye Name: 2-methyl-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]-3-nitro-benzamide CAS Name: 2-methyl-N-[1-(2-methyl-1-oxopropyl)-3,4-dihydro-2H-quinolin-7-yl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]-3-nitrobenzamide Traditional Name: N-(1-isobutyryl-3,4-dihydro-2H-quinolin-7-yl)-2-methyl-3-nitro-benzamide Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(CCCN3C(=O)C(C)C)C=C2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(CCCN3C(=O)C(C)C)C=C2

InChI

InChI=1S/C21H23N3O4/c1-13(2)21(26)23-11-5-6-15-9-10-16(12-19(15)23)22-20(25)17-7-4-8-18(14(17)3)24(27)28/h4,7-10,12-13H,5-6,11H2,1-3H3,(H,22,25)