ethanenitrile; methyl (4S)-2-oxidanylidene-1,3-oxazolidin-3-ide-4-carboxylate; rhodium(2+)

Systemtic Name: ethanenitrile; methyl (4S)-2-oxidanylidene-1,3-oxazolidin-3-ide-4-carboxylate; rhodium(2+) Openeye Name: acetonitrile; methyl (4S)-2-oxooxazolidin-3-ide-4-carboxylate; rhodium(2+) CAS Name: acetonitrile; (4S)-2-oxo-4-oxazolidin-3-idecarboxylic acid methyl ester; rhodium(2+) IUPAC Name: acetonitrile; methyl (4S)-2-oxo-1,3-oxazolidin-3-ide-4-carboxylate; rhodium(2+) Traditional Name: acetonitrile; (4S)-2-ketooxazolidin-3-ide-4-carboxylic acid methyl ester; rhodium(2+) Formula: C24H30N6O16Rh2 MolecularWeight: 864.3366

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC#N.COC(=O)C1COC(=O)[N-]1.COC(=O)C1COC(=O)[N-]1.COC(=O)C1COC(=O)[N-]1.COC(=O)C1COC(=O)[N-]1.[Rh+2].[Rh+2]

Isomeric SMILES

CC#N.CC#N.COC(=O)[C@@H]1COC(=O)[N-]1.COC(=O)[C@@H]1COC(=O)[N-]1.COC(=O)[C@@H]1COC(=O)[N-]1.COC(=O)[C@@H]1COC(=O)[N-]1.[Rh+2].[Rh+2]

InChI

InChI=1S/4C5H7NO4.2C2H3N.2Rh/c4*1-9-4(7)3-2-10-5(8)6-3;2*1-2-3;;/h4*3H,2H2,1H3,(H,6,8);2*1H3;;/q;;;;;;2*+2/p-4/t4*3-;;;;/m0000..../s1