tert-butyl 4-(5-azanyl-2-chloranyl-4-nitro-phenyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-azanyl-2-chloranyl-4-nitro-phenyl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(5-amino-2-chloro-4-nitro-phenyl)piperidine-1-carboxylate CAS Name: 4-(5-amino-2-chloro-4-nitrophenyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-amino-2-chloro-4-nitrophenyl)piperidine-1-carboxylate Traditional Name: 4-(5-amino-2-chloro-4-nitro-phenyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C16H22ClN3O4 MolecularWeight: 355.81658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=CC(=C(C=C2Cl)[N+](=O)[O-])N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=CC(=C(C=C2Cl)[N+](=O)[O-])N

InChI

InChI=1S/C16H22ClN3O4/c1-16(2,3)24-15(21)19-6-4-10(5-7-19)11-8-13(18)14(20(22)23)9-12(11)17/h8-10H,4-7,18H2,1-3H3