1-(2-methyl-4-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)urea

Systemtic Name: 1-(2-methyl-4-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)urea Openeye Name: 1-(2-methyl-4-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)urea CAS Name: 1-(2-methyl-4-nitrophenyl)-3-[3-(4-morpholin-4-iumyl)propyl]urea IUPAC Name: 1-(2-methyl-4-nitrophenyl)-3-(3-morpholin-4-ium-4-ylpropyl)urea Traditional Name: 1-(2-methyl-4-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)urea Formula: C15H23N4O4+ MolecularWeight: 323.36752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)NCCC[NH+]2CCOCC2

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C15H22N4O4/c1-12-11-13(19(21)22)3-4-14(12)17-15(20)16-5-2-6-18-7-9-23-10-8-18/h3-4,11H,2,5-10H2,1H3,(H2,16,17,20)/p+1