barium(2+); 5-(cyclohexyloxycarbonylamino)-2-oxidanyl-benzoate

Systemtic Name: barium(2+); 5-(cyclohexyloxycarbonylamino)-2-oxidanyl-benzoate Openeye Name: barium(2+); 5-(cyclohexoxycarbonylamino)-2-hydroxy-benzoate CAS Name: barium(2+); 5-[[cyclohexyloxy(oxo)methyl]amino]-2-hydroxybenzoate IUPAC Name: barium(2+); 5-(cyclohexyloxycarbonylamino)-2-hydroxybenzoate Traditional Name: barium(2+); 5-(cyclohexoxycarbonylamino)-2-hydroxy-benzoate Formula: C14H16BaNO5+ MolecularWeight: 415.60754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)NC2=CC(=C(C=C2)O)C(=O)[O-].[Ba+2]

Isomeric SMILES

C1CCC(CC1)OC(=O)NC2=CC(=C(C=C2)O)C(=O)[O-].[Ba+2]

InChI

InChI=1S/C14H17NO5.Ba/c16-12-7-6-9(8-11(12)13(17)18)15-14(19)20-10-4-2-1-3-5-10;/h6-8,10,16H,1-5H2,(H,15,19)(H,17,18);/q;+2/p-1