1-(2-cyanoethanoylamino)-3-(4-methyl-2-nitro-phenyl)urea

Systemtic Name: 1-(2-cyanoethanoylamino)-3-(4-methyl-2-nitro-phenyl)urea Openeye Name: 1-[(2-cyanoacetyl)amino]-3-(4-methyl-2-nitro-phenyl)urea CAS Name: 1-[(2-cyano-1-oxoethyl)amino]-3-(4-methyl-2-nitrophenyl)urea IUPAC Name: 1-[(2-cyanoacetyl)amino]-3-(4-methyl-2-nitrophenyl)urea Traditional Name: 1-[(2-cyanoacetyl)amino]-3-(4-methyl-2-nitro-phenyl)urea Formula: C11H11N5O4 MolecularWeight: 277.23614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NNC(=O)CC#N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NNC(=O)CC#N)[N+](=O)[O-]

InChI

InChI=1S/C11H11N5O4/c1-7-2-3-8(9(6-7)16(19)20)13-11(18)15-14-10(17)4-5-12/h2-3,6H,4H2,1H3,(H,14,17)(H2,13,15,18)