N-(3-chloranyl-4-ethoxy-phenyl)methanesulfonamide; 2-(4,5-dimethoxy-2-nitro-phenyl)-N-methyl-ethanamine

Systemtic Name: N-(3-chloranyl-4-ethoxy-phenyl)methanesulfonamide; 2-(4,5-dimethoxy-2-nitro-phenyl)-N-methyl-ethanamine Openeye Name: N-(3-chloro-4-ethoxy-phenyl)methanesulfonamide; 2-(4,5-dimethoxy-2-nitro-phenyl)-N-methyl-ethanamine CAS Name: N-(3-chloro-4-ethoxyphenyl)methanesulfonamide; 2-(4,5-dimethoxy-2-nitrophenyl)-N-methylethanamine IUPAC Name: N-(3-chloro-4-ethoxyphenyl)methanesulfonamide; 2-(4,5-dimethoxy-2-nitrophenyl)-N-methylethanamine Traditional Name: N-(3-chloro-4-ethoxy-phenyl)methanesulfonamide; 2-(4,5-dimethoxy-2-nitro-phenyl)ethyl-methyl-amine Formula: C20H28ClN3O7S MolecularWeight: 489.97022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C)Cl.CNCCC1=CC(=C(C=C1[N+](=O)[O-])OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C)Cl.CNCCC1=CC(=C(C=C1[N+](=O)[O-])OC)OC

InChI

InChI=1S/C11H16N2O4.C9H12ClNO3S/c1-12-5-4-8-6-10(16-2)11(17-3)7-9(8)13(14)15;1-3-14-9-5-4-7(6-8(9)10)11-15(2,12)13/h6-7,12H,4-5H2,1-3H3;4-6,11H,3H2,1-2H3