carbon monoxide; iron; [[(2R,6S)-6-oxidanylheptan-2-yl]-(phenylmethyl)amino]methanone

Systemtic Name: carbon monoxide; iron; [[(2R,6S)-6-oxidanylheptan-2-yl]-(phenylmethyl)amino]methanone Openeye Name: [benzyl-[(1R,5S)-5-hydroxy-1-methyl-hexyl]amino]methanone; carbon monoxide; iron CAS Name: carbon monoxide; [[(2R,6S)-6-hydroxyheptan-2-yl]-(phenylmethyl)amino]methanone; iron IUPAC Name: [benzyl-[(2R,6S)-6-hydroxyheptan-2-yl]amino]methanone; carbon monoxide; iron Traditional Name: [benzyl-[(1R,5S)-5-hydroxy-1-methyl-hexyl]amino]methanone; carbon monoxide; iron Formula: C18H19FeNO5- MolecularWeight: 385.19216

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Descriptors Computed from Structure

Canonical SMILES:

CC([CH][CH][CH]C(C)O)N(CC1=CC=CC=C1)[C-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO2.3CO.Fe/c1-13(7-6-8-14(2)18)16(12-17)11-15-9-4-3-5-10-15;3*1-2;/h3-10,13-14,18H,11H2,1-2H3;;;;/q-1;;;;/t13-,14+;;;;/m1..../s1