bis(oxidanylidene)uranium(2+); [1-(piperidin-1-ylmethyl)naphthalen-2-yl]oxidanium; diethanoate

Systemtic Name: bis(oxidanylidene)uranium(2+); [1-(piperidin-1-ylmethyl)naphthalen-2-yl]oxidanium; diethanoate Openeye Name: dioxouranium(2+); [1-(1-piperidylmethyl)-2-naphthyl]oxonium; diacetate CAS Name: dioxouranium(2+); [1-(1-piperidinylmethyl)-2-naphthalenyl]oxonium; diacetate IUPAC Name: dioxouranium(2+); [1-(piperidin-1-ylmethyl)naphthalen-2-yl]oxidanium; diacetate Traditional Name: diketouranium(2+); [1-(piperidinomethyl)-2-naphthyl]oxonium; diacetate Formula: C36H46N2O10U2+4 MolecularWeight: 1142.81566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CC(=O)[O-].C1CCN(CC1)CC2=C(C=CC3=CC=CC=C32)[OH2+].C1CCN(CC1)CC2=C(C=CC3=CC=CC=C32)[OH2+].O=[U+2]=O.O=[U+2]=O

Isomeric SMILES

CC(=O)[O-].CC(=O)[O-].C1CCN(CC1)CC2=C(C=CC3=CC=CC=C32)[OH2+].C1CCN(CC1)CC2=C(C=CC3=CC=CC=C32)[OH2+].O=[U+2]=O.O=[U+2]=O

InChI

InChI=1S/2C16H19NO.2C2H4O2.4O.2U/c2*18-16-9-8-13-6-2-3-7-14(13)15(16)12-17-10-4-1-5-11-17;2*1-2(3)4;;;;;;/h2*2-3,6-9,18H,1,4-5,10-12H2;2*1H3,(H,3,4);;;;;;/q;;;;;;;;2*+2