N-[3-(imidazol-1-ylmethyl)-2-nitro-phenyl]ethanamide

Systemtic Name: N-[3-(imidazol-1-ylmethyl)-2-nitro-phenyl]ethanamide Openeye Name: N-[3-(imidazol-1-ylmethyl)-2-nitro-phenyl]acetamide CAS Name: N-[3-(1-imidazolylmethyl)-2-nitrophenyl]acetamide IUPAC Name: N-[3-(imidazol-1-ylmethyl)-2-nitrophenyl]acetamide Traditional Name: N-[3-(imidazol-1-ylmethyl)-2-nitro-phenyl]acetamide Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1[N+](=O)[O-])CN2C=CN=C2

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1[N+](=O)[O-])CN2C=CN=C2

InChI

InChI=1S/C12H12N4O3/c1-9(17)14-11-4-2-3-10(12(11)16(18)19)7-15-6-5-13-8-15/h2-6,8H,7H2,1H3,(H,14,17)