(4-nitrophenyl)methyl N-(3-chloranyl-2,5,6-trimethyl-4-oxidanyl-phenyl)carbamate

Systemtic Name: (4-nitrophenyl)methyl N-(3-chloranyl-2,5,6-trimethyl-4-oxidanyl-phenyl)carbamate Openeye Name: (4-nitrophenyl)methyl N-(3-chloro-4-hydroxy-2,5,6-trimethyl-phenyl)carbamate CAS Name: N-(3-chloro-4-hydroxy-2,5,6-trimethylphenyl)carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-(3-chloro-4-hydroxy-2,5,6-trimethylphenyl)carbamate Traditional Name: N-(3-chloro-4-hydroxy-2,5,6-trimethyl-phenyl)carbamic acid (4-nitrobenzyl) ester Formula: C17H17ClN2O5 MolecularWeight: 364.78028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C)Cl)O)C

Isomeric SMILES

CC1=C(C(=C(C(=C1NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C)Cl)O)C

InChI

InChI=1S/C17H17ClN2O5/c1-9-10(2)16(21)14(18)11(3)15(9)19-17(22)25-8-12-4-6-13(7-5-12)20(23)24/h4-7,21H,8H2,1-3H3,(H,19,22)