N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-methyl-2-nitro-benzamide

Systemtic Name: N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-methyl-2-nitro-benzamide Openeye Name: N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-methyl-2-nitro-benzamide CAS Name: N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-methyl-2-nitrobenzamide IUPAC Name: N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-methyl-2-nitrobenzamide Traditional Name: N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-methyl-2-nitro-benzamide Formula: C14H15N5O3 MolecularWeight: 301.3006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCC2=NN=C3N2CCC3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCC2=NN=C3N2CCC3

InChI

InChI=1S/C14H15N5O3/c1-9-4-2-5-10(13(9)19(21)22)14(20)15-8-12-17-16-11-6-3-7-18(11)12/h2,4-5H,3,6-8H2,1H3,(H,15,20)