N-[(5-ethanoyl-2-methoxy-phenyl)methyl]-N-methyl-4-(methylamino)-3-nitro-benzenesulfonamide

Systemtic Name: N-[(5-ethanoyl-2-methoxy-phenyl)methyl]-N-methyl-4-(methylamino)-3-nitro-benzenesulfonamide Openeye Name: N-[(5-acetyl-2-methoxy-phenyl)methyl]-N-methyl-4-(methylamino)-3-nitro-benzenesulfonamide CAS Name: N-[(5-acetyl-2-methoxyphenyl)methyl]-N-methyl-4-(methylamino)-3-nitrobenzenesulfonamide IUPAC Name: N-[(5-acetyl-2-methoxyphenyl)methyl]-N-methyl-4-(methylamino)-3-nitrobenzenesulfonamide Traditional Name: N-(5-acetyl-2-methoxy-benzyl)-N-methyl-4-(methylamino)-3-nitro-benzenesulfonamide Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O6S/c1-12(22)13-5-8-18(27-4)14(9-13)11-20(3)28(25,26)15-6-7-16(19-2)17(10-15)21(23)24/h5-10,19H,11H2,1-4H3