2-cyclopentyl-4,5-diphenyl-1,3-dioxolane; iron(2+); methyl (Z)-3-cyclopentyl-2-(phenylmethoxycarbonylamino)prop-2-enoate

Systemtic Name: 2-cyclopentyl-4,5-diphenyl-1,3-dioxolane; iron(2+); methyl (Z)-3-cyclopentyl-2-(phenylmethoxycarbonylamino)prop-2-enoate Openeye Name: ferrous; 2-cyclopentyl-4,5-diphenyl-1,3-dioxolane; methyl (Z)-2-(benzyloxycarbonylamino)-3-cyclopentyl-prop-2-enoate CAS Name: 2-cyclopentyl-4,5-diphenyl-1,3-dioxolane; (Z)-3-cyclopentyl-2-(phenylmethoxycarbonylamino)-2-propenoic acid methyl ester; iron(2+) IUPAC Name: 2-cyclopentyl-4,5-diphenyl-1,3-dioxolane; iron(2+); methyl (Z)-3-cyclopentyl-2-(phenylmethoxycarbonylamino)prop-2-enoate Traditional Name: ferrous; (Z)-2-(benzyloxycarbonylamino)-3-cyclopentyl-acrylic acid methyl ester; 2-cyclopentyl-4,5-diphenyl-1,3-dioxolane Formula: C37H33FeNO6+2 MolecularWeight: 643.50602

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C[C]1[CH][CH][CH][CH]1)NC(=O)OCC2=CC=CC=C2.C1=CC=C(C=C1)C2C(OC(O2)[C]3[CH][CH][CH][CH]3)C4=CC=CC=C4.[Fe+2]

Isomeric SMILES

COC(=O)/C(=C/[C]1[CH][CH][CH][CH]1)/NC(=O)OCC2=CC=CC=C2.C1=CC=C(C=C1)C2C(OC(O2)[C]3[CH][CH][CH][CH]3)C4=CC=CC=C4.[Fe+2]

InChI

InChI=1S/C20H17O2.C17H16NO4.Fe/c1-3-9-15(10-4-1)18-19(16-11-5-2-6-12-16)22-20(21-18)17-13-7-8-14-17;1-21-16(19)15(11-13-7-5-6-8-13)18-17(20)22-12-14-9-3-2-4-10-14;/h1-14,18-20H;2-11H,12H2,1H3,(H,18,20);/q;;+2