5-nitro-N-[3-[1-(4-oxidanyl-6-oxidanylidene-2-phenethyl-2-propyl-1,3-dioxin-5-yl)propyl]phenyl]pyridine-2-sulfonamide

Systemtic Name: 5-nitro-N-[3-[1-(4-oxidanyl-6-oxidanylidene-2-phenethyl-2-propyl-1,3-dioxin-5-yl)propyl]phenyl]pyridine-2-sulfonamide Openeye Name: N-[3-[1-(4-hydroxy-6-oxo-2-phenethyl-2-propyl-1,3-dioxin-5-yl)propyl]phenyl]-5-nitro-pyridine-2-sulfonamide CAS Name: N-[3-[1-(4-hydroxy-6-oxo-2-phenethyl-2-propyl-1,3-dioxin-5-yl)propyl]phenyl]-5-nitro-2-pyridinesulfonamide IUPAC Name: N-[3-[1-(4-hydroxy-6-oxo-2-phenethyl-2-propyl-1,3-dioxin-5-yl)propyl]phenyl]-5-nitropyridine-2-sulfonamide Traditional Name: N-[3-[1-(4-hydroxy-6-keto-2-phenethyl-2-propyl-1,3-dioxin-5-yl)propyl]phenyl]-5-nitro-pyridine-2-sulfonamide Formula: C29H31N3O8S MolecularWeight: 581.63674

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(OC(=C(C(=O)O1)C(CC)C2=CC(=CC=C2)NS(=O)(=O)C3=NC=C(C=C3)[N+](=O)[O-])O)CCC4=CC=CC=C4

Isomeric SMILES

CCCC1(OC(=C(C(=O)O1)C(CC)C2=CC(=CC=C2)NS(=O)(=O)C3=NC=C(C=C3)[N+](=O)[O-])O)CCC4=CC=CC=C4

InChI

InChI=1S/C29H31N3O8S/c1-3-16-29(17-15-20-9-6-5-7-10-20)39-27(33)26(28(34)40-29)24(4-2)21-11-8-12-22(18-21)31-41(37,38)25-14-13-23(19-30-25)32(35)36/h5-14,18-19,24,31,33H,3-4,15-17H2,1-2H3