2-(2-methyl-5-nitro-imidazol-1-yl)ethyl N-[(2-pyrrol-1-ylphenyl)carbonylamino]carbamate

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl N-[(2-pyrrol-1-ylphenyl)carbonylamino]carbamate Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl N-[(2-pyrrol-1-ylbenzoyl)amino]carbamate CAS Name: N-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]amino]carbamic acid 2-(2-methyl-5-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl N-[(2-pyrrol-1-ylbenzoyl)amino]carbamate Traditional Name: N-[(2-pyrrol-1-ylbenzoyl)amino]carbamic acid 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl ester Formula: C18H18N6O5 MolecularWeight: 398.37272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(=O)NNC(=O)C2=CC=CC=C2N3C=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(=O)NNC(=O)C2=CC=CC=C2N3C=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O5/c1-13-19-12-16(24(27)28)23(13)10-11-29-18(26)21-20-17(25)14-6-2-3-7-15(14)22-8-4-5-9-22/h2-9,12H,10-11H2,1H3,(H,20,25)(H,21,26)