3-nitro-N-[(1-propan-2-ylpiperidin-1-ium-4-ylidene)amino]benzamide

Systemtic Name: 3-nitro-N-[(1-propan-2-ylpiperidin-1-ium-4-ylidene)amino]benzamide Openeye Name: N-[(1-isopropylpiperidin-1-ium-4-ylidene)amino]-3-nitro-benzamide CAS Name: 3-nitro-N-[(1-propan-2-yl-4-piperidin-1-iumylidene)amino]benzamide IUPAC Name: 3-nitro-N-[(1-propan-2-ylpiperidin-1-ium-4-ylidene)amino]benzamide Traditional Name: N-[(1-isopropylpiperidin-1-ium-4-ylidene)amino]-3-nitro-benzamide Formula: C15H21N4O3+ MolecularWeight: 305.35224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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