N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N,2-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N,2-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-N,2-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N,2-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N,2-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-N,2-dimethyl-5-nitro-benzenesulfonamide Formula: C16H17BrN2O5S MolecularWeight: 429.28558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C16H17BrN2O5S/c1-11-4-6-14(19(20)21)9-16(11)25(22,23)18(2)10-12-8-13(17)5-7-15(12)24-3/h4-9H,10H2,1-3H3