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

Systemtic Name: N-(1-cyclopropylcarbonyl-3,4-dihydro-2H-quinolin-7-yl)-2-methyl-3-nitro-benzamide Openeye Name: N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-2-methyl-3-nitro-benzamide CAS Name: N-[1-[cyclopropyl(oxo)methyl]-3,4-dihydro-2H-quinolin-7-yl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-2-methyl-3-nitrobenzamide Traditional Name: N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-2-methyl-3-nitro-benzamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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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)C4CC4)C=C2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(CCCN3C(=O)C4CC4)C=C2

InChI

InChI=1S/C21H21N3O4/c1-13-17(5-2-6-18(13)24(27)28)20(25)22-16-10-9-14-4-3-11-23(19(14)12-16)21(26)15-7-8-15/h2,5-6,9-10,12,15H,3-4,7-8,11H2,1H3,(H,22,25)