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

Systemtic Name: N-(2-methyl-1-octanoyl-3,4-dihydro-2H-quinolin-4-yl)-4-nitro-N-phenyl-benzamide Openeye Name: N-(2-methyl-1-octanoyl-3,4-dihydro-2H-quinolin-4-yl)-4-nitro-N-phenyl-benzamide CAS Name: N-[2-methyl-1-(1-oxooctyl)-3,4-dihydro-2H-quinolin-4-yl]-4-nitro-N-phenylbenzamide IUPAC Name: N-(2-methyl-1-octanoyl-3,4-dihydro-2H-quinolin-4-yl)-4-nitro-N-phenylbenzamide Traditional Name: N-(1-caprylyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-4-nitro-N-phenyl-benzamide Formula: C31H35N3O4 MolecularWeight: 513.6273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1C(CC(C2=CC=CC=C21)N(C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CCCCCCCC(=O)N1C(CC(C2=CC=CC=C21)N(C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C31H35N3O4/c1-3-4-5-6-10-17-30(35)32-23(2)22-29(27-15-11-12-16-28(27)32)33(25-13-8-7-9-14-25)31(36)24-18-20-26(21-19-24)34(37)38/h7-9,11-16,18-21,23,29H,3-6,10,17,22H2,1-2H3