1-(4-chloranyl-3-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)urea

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)urea Openeye Name: 1-(4-chloro-3-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)urea CAS Name: 1-(4-chloro-3-nitrophenyl)-3-[3-(4-morpholin-4-iumyl)propyl]urea IUPAC Name: 1-(4-chloro-3-nitrophenyl)-3-(3-morpholin-4-ium-4-ylpropyl)urea Traditional Name: 1-(4-chloro-3-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)urea Formula: C14H20ClN4O4+ MolecularWeight: 343.786

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H19ClN4O4/c15-12-3-2-11(10-13(12)19(21)22)17-14(20)16-4-1-5-18-6-8-23-9-7-18/h2-3,10H,1,4-9H2,(H2,16,17,20)/p+1