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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4/c1-13-4-5-16(11-18(13)24(27)28)20(25)22-17-9-8-14-3-2-10-23(19(14)12-17)21(26)15-6-7-15/h4-5,8-9,11-12,15H,2-3,6-7,10H2,1H3,(H,22,25)