methyl 1-[3-[2-(4-nitrophenyl)ethanoylamino]propyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-[3-[2-(4-nitrophenyl)ethanoylamino]propyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[3-[[2-(4-nitrophenyl)acetyl]amino]propyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[3-[[2-(4-nitrophenyl)-1-oxoethyl]amino]propyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-[[2-(4-nitrophenyl)acetyl]amino]propyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[3-[[2-(4-nitrophenyl)acetyl]amino]propyl]-4-phenyl-isonipecotic acid methyl ester Formula: C24H29N3O5 MolecularWeight: 439.50416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)CCCNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1(CCN(CC1)CCCNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C24H29N3O5/c1-32-23(29)24(20-6-3-2-4-7-20)12-16-26(17-13-24)15-5-14-25-22(28)18-19-8-10-21(11-9-19)27(30)31/h2-4,6-11H,5,12-18H2,1H3,(H,25,28)