N-(1-methoxypropan-2-yl)-3-nitro-4-(phenethylamino)benzenesulfonamide

Systemtic Name: N-(1-methoxypropan-2-yl)-3-nitro-4-(phenethylamino)benzenesulfonamide Openeye Name: N-(2-methoxy-1-methyl-ethyl)-3-nitro-4-(phenethylamino)benzenesulfonamide CAS Name: N-(1-methoxypropan-2-yl)-3-nitro-4-(phenethylamino)benzenesulfonamide IUPAC Name: N-(1-methoxypropan-2-yl)-3-nitro-4-(phenethylamino)benzenesulfonamide Traditional Name: N-(2-methoxy-1-methyl-ethyl)-3-nitro-4-(phenethylamino)benzenesulfonamide Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(COC)NS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5S/c1-14(13-26-2)20-27(24,25)16-8-9-17(18(12-16)21(22)23)19-11-10-15-6-4-3-5-7-15/h3-9,12,14,19-20H,10-11,13H2,1-2H3