1-(2-methoxy-4-nitro-phenyl)-3-(1-methylpiperidin-1-ium-4-yl)urea

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-(1-methylpiperidin-1-ium-4-yl)urea Openeye Name: 1-(2-methoxy-4-nitro-phenyl)-3-(1-methylpiperidin-1-ium-4-yl)urea CAS Name: 1-(2-methoxy-4-nitrophenyl)-3-(1-methyl-4-piperidin-1-iumyl)urea IUPAC Name: 1-(2-methoxy-4-nitrophenyl)-3-(1-methylpiperidin-1-ium-4-yl)urea Traditional Name: 1-(2-methoxy-4-nitro-phenyl)-3-(1-methylpiperidin-1-ium-4-yl)urea Formula: C14H21N4O4+ MolecularWeight: 309.34094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C14H20N4O4/c1-17-7-5-10(6-8-17)15-14(19)16-12-4-3-11(18(20)21)9-13(12)22-2/h3-4,9-10H,5-8H2,1-2H3,(H2,15,16,19)/p+1