1-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-(4-nitrophenyl)urea

Systemtic Name: 1-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-(4-nitrophenyl)urea Openeye Name: 1-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-(4-nitrophenyl)urea CAS Name: 1-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-(4-nitrophenyl)urea IUPAC Name: 1-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-(4-nitrophenyl)urea Traditional Name: 1-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-(4-nitrophenyl)urea Formula: C13H14N6O3 MolecularWeight: 302.28866

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NN=C(N2C1)CNC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC2=NN=C(N2C1)CNC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H14N6O3/c20-13(15-9-3-5-10(6-4-9)19(21)22)14-8-12-17-16-11-2-1-7-18(11)12/h3-6H,1-2,7-8H2,(H2,14,15,20)