(E)-3-dicyclopentyloxyphosphoryl-4-(3-nitrophenyl)but-3-en-2-one

Systemtic Name: (E)-3-dicyclopentyloxyphosphoryl-4-(3-nitrophenyl)but-3-en-2-one Openeye Name: (E)-3-[bis(cyclopentoxy)phosphoryl]-4-(3-nitrophenyl)but-3-en-2-one CAS Name: (E)-3-dicyclopentyloxyphosphoryl-4-(3-nitrophenyl)-3-buten-2-one IUPAC Name: (E)-3-dicyclopentyloxyphosphoryl-4-(3-nitrophenyl)but-3-en-2-one Traditional Name: (E)-3-[bis(cyclopentoxy)phosphoryl]-4-(3-nitrophenyl)but-3-en-2-one Formula: C20H26NO6P MolecularWeight: 407.397301

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])P(=O)(OC2CCCC2)OC3CCCC3

Isomeric SMILES

CC(=O)/C(=C\C1=CC(=CC=C1)[N+](=O)[O-])/P(=O)(OC2CCCC2)OC3CCCC3

InChI

InChI=1S/C20H26NO6P/c1-15(22)20(14-16-7-6-8-17(13-16)21(23)24)28(25,26-18-9-2-3-10-18)27-19-11-4-5-12-19/h6-8,13-14,18-19H,2-5,9-12H2,1H3/b20-14+