1-(1-methylbenzotriazol-5-yl)-3-(3-nitrophenyl)urea

Systemtic Name: 1-(1-methylbenzotriazol-5-yl)-3-(3-nitrophenyl)urea Openeye Name: 1-(1-methylbenzotriazol-5-yl)-3-(3-nitrophenyl)urea CAS Name: 1-(1-methyl-5-benzotriazolyl)-3-(3-nitrophenyl)urea IUPAC Name: 1-(1-methylbenzotriazol-5-yl)-3-(3-nitrophenyl)urea Traditional Name: 1-(1-methylbenzotriazol-5-yl)-3-(3-nitrophenyl)urea Formula: C14H12N6O3 MolecularWeight: 312.28348

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])N=N1

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])N=N1

InChI

InChI=1S/C14H12N6O3/c1-19-13-6-5-10(8-12(13)17-18-19)16-14(21)15-9-3-2-4-11(7-9)20(22)23/h2-8H,1H3,(H2,15,16,21)