2-(4-nitrophenyl)sulfonylethyl N-[4-(diethylamino)-2,6-dimethyl-phenyl]carbamate

Systemtic Name: 2-(4-nitrophenyl)sulfonylethyl N-[4-(diethylamino)-2,6-dimethyl-phenyl]carbamate Openeye Name: 2-(4-nitrophenyl)sulfonylethyl N-[4-(diethylamino)-2,6-dimethyl-phenyl]carbamate CAS Name: N-[4-(diethylamino)-2,6-dimethylphenyl]carbamic acid 2-(4-nitrophenyl)sulfonylethyl ester IUPAC Name: 2-(4-nitrophenyl)sulfonylethyl N-[4-(diethylamino)-2,6-dimethylphenyl]carbamate Traditional Name: N-[4-(diethylamino)-2,6-dimethyl-phenyl]carbamic acid 2-nosylethyl ester Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C(=C1)C)NC(=O)OCCS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)C1=CC(=C(C(=C1)C)NC(=O)OCCS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C21H27N3O6S/c1-5-23(6-2)18-13-15(3)20(16(4)14-18)22-21(25)30-11-12-31(28,29)19-9-7-17(8-10-19)24(26)27/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,22,25)