N-[(1R)-1-cyclopentylethyl]-4-methyl-benzenesulfonamide; iron(2+)

Systemtic Name: N-[(1R)-1-cyclopentylethyl]-4-methyl-benzenesulfonamide; iron(2+) Openeye Name: ferrous N-[(1R)-1-cyclopentylethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1R)-1-cyclopentylethyl]-4-methylbenzenesulfonamide; iron(2+) IUPAC Name: N-[(1R)-1-cyclopentylethyl]-4-methylbenzenesulfonamide; iron(2+) Traditional Name: ferrous N-[(1R)-1-cyclopentylethyl]-4-methyl-benzenesulfonamide Formula: C28H32FeN2O4S2+2 MolecularWeight: 580.53968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)[C]2[CH][CH][CH][CH]2.CC1=CC=C(C=C1)S(=O)(=O)NC(C)[C]2[CH][CH][CH][CH]2.[Fe+2]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C)[C]2[CH][CH][CH][CH]2.CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C)[C]2[CH][CH][CH][CH]2.[Fe+2]

InChI

InChI=1S/2C14H16NO2S.Fe/c2*1-11-7-9-14(10-8-11)18(16,17)15-12(2)13-5-3-4-6-13;/h2*3-10,12,15H,1-2H3;/q;;+2/t2*12-;/m11./s1