2-(5-methyl-2-nitro-imidazol-1-yl)ethyl N-(3-methylphenyl)carbonylcarbamate

Systemtic Name: 2-(5-methyl-2-nitro-imidazol-1-yl)ethyl N-(3-methylphenyl)carbonylcarbamate Openeye Name: 2-(5-methyl-2-nitro-imidazol-1-yl)ethyl N-(3-methylbenzoyl)carbamate CAS Name: N-[(3-methylphenyl)-oxomethyl]carbamic acid 2-(5-methyl-2-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(5-methyl-2-nitroimidazol-1-yl)ethyl N-(3-methylbenzoyl)carbamate Traditional Name: N-m-toluoylcarbamic acid 2-(5-methyl-2-nitro-imidazol-1-yl)ethyl ester Formula: C15H16N4O5 MolecularWeight: 332.31134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(=O)OCCN2C(=CN=C2[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(=O)OCCN2C(=CN=C2[N+](=O)[O-])C

InChI

InChI=1S/C15H16N4O5/c1-10-4-3-5-12(8-10)13(20)17-15(21)24-7-6-18-11(2)9-16-14(18)19(22)23/h3-5,8-9H,6-7H2,1-2H3,(H,17,20,21)