methyl N-[2-nitro-5-[3-oxidanyl-4-(phenylcarbonyl)phenoxy]phenyl]carbamate

Systemtic Name: methyl N-[2-nitro-5-[3-oxidanyl-4-(phenylcarbonyl)phenoxy]phenyl]carbamate Openeye Name: methyl N-[5-(4-benzoyl-3-hydroxy-phenoxy)-2-nitro-phenyl]carbamate CAS Name: N-[5-(4-benzoyl-3-hydroxyphenoxy)-2-nitrophenyl]carbamic acid methyl ester IUPAC Name: methyl N-[5-(4-benzoyl-3-hydroxyphenoxy)-2-nitrophenyl]carbamate Traditional Name: N-[5-(4-benzoyl-3-hydroxy-phenoxy)-2-nitro-phenyl]carbamic acid methyl ester Formula: C21H16N2O7 MolecularWeight: 408.36094

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=C(C=CC(=C1)OC2=CC(=C(C=C2)C(=O)C3=CC=CC=C3)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)NC1=C(C=CC(=C1)OC2=CC(=C(C=C2)C(=O)C3=CC=CC=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C21H16N2O7/c1-29-21(26)22-17-11-14(8-10-18(17)23(27)28)30-15-7-9-16(19(24)12-15)20(25)13-5-3-2-4-6-13/h2-12,24H,1H3,(H,22,26)