1-[[4-(4-methoxyphenyl)-5-nitro-pentan-2-ylidene]amino]urea

Systemtic Name: 1-[[4-(4-methoxyphenyl)-5-nitro-pentan-2-ylidene]amino]urea Openeye Name: [[3-(4-methoxyphenyl)-1-methyl-4-nitro-butylidene]amino]urea CAS Name: [[4-(4-methoxyphenyl)-5-nitropentan-2-ylidene]amino]urea IUPAC Name: [[4-(4-methoxyphenyl)-5-nitropentan-2-ylidene]amino]urea Traditional Name: [[3-(4-methoxyphenyl)-1-methyl-4-nitro-butylidene]amino]urea Formula: C13H18N4O4 MolecularWeight: 294.30642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)N)CC(C[N+](=O)[O-])C1=CC=C(C=C1)OC

Isomeric SMILES

CC(=NNC(=O)N)CC(C[N+](=O)[O-])C1=CC=C(C=C1)OC

InChI

InChI=1S/C13H18N4O4/c1-9(15-16-13(14)18)7-11(8-17(19)20)10-3-5-12(21-2)6-4-10/h3-6,11H,7-8H2,1-2H3,(H3,14,16,18)