strontium 3-[(3-nitrophenyl)carbonylamino]-5-sulfonato-benzoate hexahydrate

Systemtic Name: strontium 3-[(3-nitrophenyl)carbonylamino]-5-sulfonato-benzoate hexahydrate Openeye Name: strontium 3-[(3-nitrobenzoyl)amino]-5-sulfonato-benzoate hexahydrate CAS Name: strontium 3-[[(3-nitrophenyl)-oxomethyl]amino]-5-sulfonatobenzoate hexahydrate IUPAC Name: strontium 3-[(3-nitrobenzoyl)amino]-5-sulfonatobenzoate hexahydrate Traditional Name: strontium 3-[(3-nitrobenzoyl)amino]-5-sulfonato-benzoate hexahydrate Formula: C14H20N2O14SSr MolecularWeight: 559.9986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)C(=O)[O-])S(=O)(=O)[O-].O.O.O.O.O.O.[Sr+2]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)C(=O)[O-])S(=O)(=O)[O-].O.O.O.O.O.O.[Sr+2]

InChI

InChI=1S/C14H10N2O8S.6H2O.Sr/c17-13(8-2-1-3-11(5-8)16(20)21)15-10-4-9(14(18)19)6-12(7-10)25(22,23)24;;;;;;;/h1-7H,(H,15,17)(H,18,19)(H,22,23,24);6*1H2;/q;;;;;;;+2/p-2