phenyl N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]carbamate

Systemtic Name: phenyl N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]carbamate Openeye Name: phenyl N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]carbamate CAS Name: N-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl]carbamic acid phenyl ester IUPAC Name: phenyl N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]carbamate Traditional Name: N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]carbamic acid phenyl ester Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCNC(=O)OC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCNC(=O)OC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O4/c1-10-15-9-12(17(19)20)16(10)8-7-14-13(18)21-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3,(H,14,18)