N-[(E)-(1-methylpiperidin-3-yl)methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-(1-methylpiperidin-3-yl)methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(1-methyl-3-piperidyl)methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-(1-methyl-3-piperidinyl)methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(1-methylpiperidin-3-yl)methylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-(1-methyl-3-piperidyl)methyleneamino]amine Formula: C13H17N5O4 MolecularWeight: 307.30518

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1CCCC(C1)/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H17N5O4/c1-16-6-2-3-10(9-16)8-14-15-12-5-4-11(17(19)20)7-13(12)18(21)22/h4-5,7-8,10,15H,2-3,6,9H2,1H3/b14-8+