[4-(methylamino)-3-nitro-phenyl]-piperidin-1-yl-methanone

Systemtic Name: [4-(methylamino)-3-nitro-phenyl]-piperidin-1-yl-methanone Openeye Name: [4-(methylamino)-3-nitro-phenyl]-(1-piperidyl)methanone CAS Name: [4-(methylamino)-3-nitrophenyl]-(1-piperidinyl)methanone IUPAC Name: [4-(methylamino)-3-nitrophenyl]-piperidin-1-ylmethanone Traditional Name: [4-(methylamino)-3-nitro-phenyl]-piperidino-methanone Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O3/c1-14-11-6-5-10(9-12(11)16(18)19)13(17)15-7-3-2-4-8-15/h5-6,9,14H,2-4,7-8H2,1H3