3-nitro-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]benzamide

Systemtic Name: 3-nitro-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]benzamide Openeye Name: 3-nitro-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]benzamide CAS Name: 3-nitro-N-[(1-propyl-4-piperidin-1-iumylidene)amino]benzamide IUPAC Name: 3-nitro-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]benzamide Traditional Name: 3-nitro-N-[(1-propylpiperidin-1-ium-4-ylidene)amino]benzamide Formula: C15H21N4O3+ MolecularWeight: 305.35224

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(=NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])CC1

Isomeric SMILES

CCC[NH+]1CCC(=NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])CC1

InChI

InChI=1S/C15H20N4O3/c1-2-8-18-9-6-13(7-10-18)16-17-15(20)12-4-3-5-14(11-12)19(21)22/h3-5,11H,2,6-10H2,1H3,(H,17,20)/p+1