[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]methyl N-cyclohexylcarbamate

Systemtic Name: [4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]methyl N-cyclohexylcarbamate Openeye Name: [4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]methyl N-cyclohexylcarbamate CAS Name: N-cyclohexylcarbamic acid [4-[(4-chlorophenyl)thio]-3-nitrophenyl]methyl ester IUPAC Name: [4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]methyl N-cyclohexylcarbamate Traditional Name: N-cyclohexylcarbamic acid [4-[(4-chlorophenyl)thio]-3-nitro-benzyl] ester Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)OCC2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)OCC2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H21ClN2O4S/c21-15-7-9-17(10-8-15)28-19-11-6-14(12-18(19)23(25)26)13-27-20(24)22-16-4-2-1-3-5-16/h6-12,16H,1-5,13H2,(H,22,24)