4-[3-(3,5-dimethylpiperidin-1-yl)propylamino]-N-(3-fluoranyl-4-methyl-phenyl)-3-nitro-benzamide

Systemtic Name: 4-[3-(3,5-dimethylpiperidin-1-yl)propylamino]-N-(3-fluoranyl-4-methyl-phenyl)-3-nitro-benzamide Openeye Name: 4-[3-(3,5-dimethyl-1-piperidyl)propylamino]-N-(3-fluoro-4-methyl-phenyl)-3-nitro-benzamide CAS Name: 4-[3-(3,5-dimethyl-1-piperidinyl)propylamino]-N-(3-fluoro-4-methylphenyl)-3-nitrobenzamide IUPAC Name: 4-[3-(3,5-dimethylpiperidin-1-yl)propylamino]-N-(3-fluoro-4-methylphenyl)-3-nitrobenzamide Traditional Name: 4-[3-(3,5-dimethylpiperidino)propylamino]-N-(3-fluoro-4-methyl-phenyl)-3-nitro-benzamide Formula: C24H31FN4O3 MolecularWeight: 442.526343

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CCCNC2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)C)F)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)CCCNC2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)C)F)[N+](=O)[O-])C

InChI

InChI=1S/C24H31FN4O3/c1-16-11-17(2)15-28(14-16)10-4-9-26-22-8-6-19(12-23(22)29(31)32)24(30)27-20-7-5-18(3)21(25)13-20/h5-8,12-13,16-17,26H,4,9-11,14-15H2,1-3H3,(H,27,30)