carbon monoxide; cyclopentane; iron(2+); prop-2-enylsulfonylbenzene; triphenylphosphane

Systemtic Name: carbon monoxide; cyclopentane; iron(2+); prop-2-enylsulfonylbenzene; triphenylphosphane Openeye Name: ferrous; allylsulfonylbenzene; carbon monoxide; cyclopentane; triphenylphosphane CAS Name: carbon monoxide; cyclopentane; iron(2+); prop-2-enylsulfonylbenzene; triphenylphosphine IUPAC Name: carbon monoxide; cyclopentane; iron(2+); prop-2-enylsulfonylbenzene; triphenylphosphane Traditional Name: ferrous; allylsulfonylbenzene; carbon monoxide; cyclopentane; triphenylphosphine Formula: C33H29FeO3PS+ MolecularWeight: 592.465321

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Descriptors Computed from Structure

Canonical SMILES:

C=[C-]CS(=O)(=O)C1=CC=CC=C1.[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C=[C-]CS(=O)(=O)C1=CC=CC=C1.[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C18H15P.C9H9O2S.C5H5.CO.Fe/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-8-12(10,11)9-6-4-3-5-7-9;1-2-4-5-3-1;1-2;/h1-15H;3-7H,1,8H2;1-5H;;/q;-1;;;+2