N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[4-[(2-methoxy-1-methyl-ethyl)sulfamoyl]phenyl]-3-methyl-4-nitro-benzamide CAS Name: N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[4-[(2-methoxy-1-methyl-ethyl)sulfamoyl]phenyl]-3-methyl-4-nitro-benzamide Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(C)COC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(C)COC)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O6S/c1-12-10-14(4-9-17(12)21(23)24)18(22)19-15-5-7-16(8-6-15)28(25,26)20-13(2)11-27-3/h4-10,13,20H,11H2,1-3H3,(H,19,22)