tert-butyl 4-[[1-(2-nitrophenyl)-3-oxidanylidene-3-propan-2-yloxy-propyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[1-(2-nitrophenyl)-3-oxidanylidene-3-propan-2-yloxy-propyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-isopropoxy-1-(2-nitrophenyl)-3-oxo-propyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[1-(2-nitrophenyl)-3-oxo-3-propan-2-yloxypropyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[1-(2-nitrophenyl)-3-oxo-3-propan-2-yloxypropyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[3-isopropoxy-3-keto-1-(2-nitrophenyl)propyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H33N3O7 MolecularWeight: 463.52402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H33N3O7/c1-15(2)32-20(27)14-18(17-8-6-7-9-19(17)26(30)31)24-21(28)16-10-12-25(13-11-16)22(29)33-23(3,4)5/h6-9,15-16,18H,10-14H2,1-5H3,(H,24,28)