cyclopentane; 2-ethoxyethyl (E)-2-cyano-3-(cyclopentylmethylamino)prop-2-enoate; iron(2+)

Systemtic Name: cyclopentane; 2-ethoxyethyl (E)-2-cyano-3-(cyclopentylmethylamino)prop-2-enoate; iron(2+) Openeye Name: ferrous; cyclopentane; 2-ethoxyethyl (E)-2-cyano-3-(cyclopentylmethylamino)prop-2-enoate CAS Name: (E)-2-cyano-3-(cyclopentylmethylamino)-2-propenoic acid 2-ethoxyethyl ester; cyclopentane; iron(2+) IUPAC Name: cyclopentane; 2-ethoxyethyl (E)-2-cyano-3-(cyclopentylmethylamino)prop-2-enoate; iron(2+) Traditional Name: ferrous; (E)-2-cyano-3-(cyclopentylmethylamino)acrylic acid 2-ethoxyethyl ester; cyclopentane Formula: C19H22FeN2O3+2 MolecularWeight: 382.23458

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C(=CNC[C]1[CH][CH][CH][CH]1)C#N.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CCOCCOC(=O)/C(=C/NC[C]1[CH][CH][CH][CH]1)/C#N.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C14H17N2O3.C5H5.Fe/c1-2-18-7-8-19-14(17)13(9-15)11-16-10-12-5-3-4-6-12;1-2-4-5-3-1;/h3-6,11,16H,2,7-8,10H2,1H3;1-5H;/q;;+2/b13-11+;;