(4-chloranyl-3,5-dinitro-phenyl)-(3-methylpiperidin-1-yl)methanone

Systemtic Name: (4-chloranyl-3,5-dinitro-phenyl)-(3-methylpiperidin-1-yl)methanone Openeye Name: (4-chloro-3,5-dinitro-phenyl)-(3-methyl-1-piperidyl)methanone CAS Name: (4-chloro-3,5-dinitrophenyl)-(3-methyl-1-piperidinyl)methanone IUPAC Name: (4-chloro-3,5-dinitrophenyl)-(3-methylpiperidin-1-yl)methanone Traditional Name: (4-chloro-3,5-dinitro-phenyl)-(3-methylpiperidino)methanone Formula: C13H14ClN3O5 MolecularWeight: 327.72036

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H14ClN3O5/c1-8-3-2-4-15(7-8)13(18)9-5-10(16(19)20)12(14)11(6-9)17(21)22/h5-6,8H,2-4,7H2,1H3