ethyl 4-[[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-nitro-phenyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-nitro-phenyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-nitro-anilino]piperidine-1-carboxylate CAS Name: 4-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-4-nitroanilino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-nitroanilino]piperidine-1-carboxylate Traditional Name: 4-[4-nitro-2-(piperonylcarbamoyl)anilino]piperidine-1-carboxylic acid ethyl ester Formula: C23H26N4O7 MolecularWeight: 470.47514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H26N4O7/c1-2-32-23(29)26-9-7-16(8-10-26)25-19-5-4-17(27(30)31)12-18(19)22(28)24-13-15-3-6-20-21(11-15)34-14-33-20/h3-6,11-12,16,25H,2,7-10,13-14H2,1H3,(H,24,28)