N-[azanyl(morpholin-4-ium-4-ylidene)methyl]-4-nitro-benzamide

Systemtic Name: N-[azanyl(morpholin-4-ium-4-ylidene)methyl]-4-nitro-benzamide Openeye Name: N-[amino(morpholin-4-ium-4-ylidene)methyl]-4-nitro-benzamide CAS Name: N-[amino(4-morpholin-4-iumylidene)methyl]-4-nitrobenzamide IUPAC Name: N-[amino(morpholin-4-ium-4-ylidene)methyl]-4-nitrobenzamide Traditional Name: N-[amino(morpholin-4-ium-4-ylidene)methyl]-4-nitro-benzamide Formula: C12H15N4O4+ MolecularWeight: 279.2719

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]1=C(N)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1COCC[N+]1=C(N)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O4/c13-12(15-5-7-20-8-6-15)14-11(17)9-1-3-10(4-2-9)16(18)19/h1-4H,5-8H2,(H2,13,14,17)/p+1