4-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[(3,4-dimethoxyphenyl)methyl-methylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[(3,4-dimethoxyphenyl)methyl-methylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-4-[methyl(veratryl)amino]-3-nitro-benzenesulfonamide Formula: C19H25N3O6S MolecularWeight: 423.4833

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H25N3O6S/c1-13(2)20-29(25,26)15-7-8-16(17(11-15)22(23)24)21(3)12-14-6-9-18(27-4)19(10-14)28-5/h6-11,13,20H,12H2,1-5H3