N-[3-(diethylamino)-2-oxidanyl-propyl]-4-methyl-N-(3-nitrophenyl)benzenesulfonamide

Systemtic Name: N-[3-(diethylamino)-2-oxidanyl-propyl]-4-methyl-N-(3-nitrophenyl)benzenesulfonamide Openeye Name: N-[3-(diethylamino)-2-hydroxy-propyl]-4-methyl-N-(3-nitrophenyl)benzenesulfonamide CAS Name: N-[3-(diethylamino)-2-hydroxypropyl]-4-methyl-N-(3-nitrophenyl)benzenesulfonamide IUPAC Name: N-[3-(diethylamino)-2-hydroxypropyl]-4-methyl-N-(3-nitrophenyl)benzenesulfonamide Traditional Name: N-[3-(diethylamino)-2-hydroxy-propyl]-4-methyl-N-(3-nitrophenyl)benzenesulfonamide Formula: C20H27N3O5S MolecularWeight: 421.51048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O5S/c1-4-21(5-2)14-19(24)15-22(17-7-6-8-18(13-17)23(25)26)29(27,28)20-11-9-16(3)10-12-20/h6-13,19,24H,4-5,14-15H2,1-3H3