N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]piperidin-1-ium-4-carboxamide Openeye Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]piperidin-1-ium-4-carboxamide CAS Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]piperidin-1-ium-4-carboxamide Traditional Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]piperidin-1-ium-4-carboxamide Formula: C14H17N4O5+ MolecularWeight: 321.30858

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C(=O)NN=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

C1C[NH2+]CCC1C(=O)N/N=C\C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C14H16N4O5/c19-14(9-1-3-15-4-2-9)17-16-7-10-5-12-13(23-8-22-12)6-11(10)18(20)21/h5-7,9,15H,1-4,8H2,(H,17,19)/p+1/b16-7-