4-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide CAS Name: 4-[(2-methoxy-5-methylphenyl)methyl-methylamino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2-methoxy-5-methylphenyl)methyl-methylamino]-3-nitrobenzenesulfonamide Traditional Name: 4-[(2-methoxy-5-methyl-benzyl)-methyl-amino]-3-nitro-benzenesulfonamide Formula: C16H19N3O5S MolecularWeight: 365.40416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O5S/c1-11-4-7-16(24-3)12(8-11)10-18(2)14-6-5-13(25(17,22)23)9-15(14)19(20)21/h4-9H,10H2,1-3H3,(H2,17,22,23)