2-(3,5-dimethylpiperidin-1-yl)ethyl N-(5-chloranyl-2-methoxy-4-nitro-phenyl)carbamate

Systemtic Name: 2-(3,5-dimethylpiperidin-1-yl)ethyl N-(5-chloranyl-2-methoxy-4-nitro-phenyl)carbamate Openeye Name: 2-(3,5-dimethyl-1-piperidyl)ethyl N-(5-chloro-2-methoxy-4-nitro-phenyl)carbamate CAS Name: N-(5-chloro-2-methoxy-4-nitrophenyl)carbamic acid 2-(3,5-dimethyl-1-piperidinyl)ethyl ester IUPAC Name: 2-(3,5-dimethylpiperidin-1-yl)ethyl N-(5-chloro-2-methoxy-4-nitrophenyl)carbamate Traditional Name: N-(5-chloro-2-methoxy-4-nitro-phenyl)carbamic acid 2-(3,5-dimethylpiperidino)ethyl ester Formula: C17H24ClN3O5 MolecularWeight: 385.84256

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CCOC(=O)NC2=CC(=C(C=C2OC)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1CC(CN(C1)CCOC(=O)NC2=CC(=C(C=C2OC)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C17H24ClN3O5/c1-11-6-12(2)10-20(9-11)4-5-26-17(22)19-14-7-13(18)15(21(23)24)8-16(14)25-3/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,19,22)