N-butyl-N-[3-(4-hydroxyphenyl)propyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-butyl-N-[3-(4-hydroxyphenyl)propyl]-3-nitro-benzenesulfonamide Openeye Name: N-butyl-N-[3-(4-hydroxyphenyl)propyl]-3-nitro-benzenesulfonamide CAS Name: N-butyl-N-[3-(4-hydroxyphenyl)propyl]-3-nitrobenzenesulfonamide IUPAC Name: N-butyl-N-[3-(4-hydroxyphenyl)propyl]-3-nitrobenzenesulfonamide Traditional Name: N-butyl-N-[3-(4-hydroxyphenyl)propyl]-3-nitro-benzenesulfonamide Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC1=CC=C(C=C1)O)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCC1=CC=C(C=C1)O)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H24N2O5S/c1-2-3-13-20(14-5-6-16-9-11-18(22)12-10-16)27(25,26)19-8-4-7-17(15-19)21(23)24/h4,7-12,15,22H,2-3,5-6,13-14H2,1H3