(phenylmethyl) N-(6-azanyl-4-chloranyl-5-nitro-pyridin-2-yl)carbamate

Systemtic Name: (phenylmethyl) N-(6-azanyl-4-chloranyl-5-nitro-pyridin-2-yl)carbamate Openeye Name: benzyl N-(6-amino-4-chloro-5-nitro-2-pyridyl)carbamate CAS Name: N-(6-amino-4-chloro-5-nitro-2-pyridinyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(6-amino-4-chloro-5-nitropyridin-2-yl)carbamate Traditional Name: N-(6-amino-4-chloro-5-nitro-2-pyridyl)carbamic acid benzyl ester Formula: C13H11ClN4O4 MolecularWeight: 322.70384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=NC(=C(C(=C2)Cl)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=NC(=C(C(=C2)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C13H11ClN4O4/c14-9-6-10(16-12(15)11(9)18(20)21)17-13(19)22-7-8-4-2-1-3-5-8/h1-6H,7H2,(H3,15,16,17,19)