1-[3-methyl-1-[2-(3-nitrophenyl)carbonylhydrazinyl]-1-oxidanylidene-pentan-2-yl]urea

Systemtic Name: 1-[3-methyl-1-[2-(3-nitrophenyl)carbonylhydrazinyl]-1-oxidanylidene-pentan-2-yl]urea Openeye Name: [2-methyl-1-[[(3-nitrobenzoyl)amino]carbamoyl]butyl]urea CAS Name: [3-methyl-1-[[(3-nitrophenyl)-oxomethyl]hydrazo]-1-oxopentan-2-yl]urea IUPAC Name: [3-methyl-1-[2-(3-nitrobenzoyl)hydrazinyl]-1-oxopentan-2-yl]urea Traditional Name: [2-methyl-1-[[(3-nitrobenzoyl)amino]carbamoyl]butyl]urea Formula: C14H19N5O5 MolecularWeight: 337.33116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N5O5/c1-3-8(2)11(16-14(15)22)13(21)18-17-12(20)9-5-4-6-10(7-9)19(23)24/h4-8,11H,3H2,1-2H3,(H,17,20)(H,18,21)(H3,15,16,22)