zinc 4-(heptoxycarbonylamino)-2-oxidanyl-benzoate

Systemtic Name: zinc 4-(heptoxycarbonylamino)-2-oxidanyl-benzoate Openeye Name: zinc 4-(heptoxycarbonylamino)-2-hydroxy-benzoate CAS Name: zinc 4-[[heptoxy(oxo)methyl]amino]-2-hydroxybenzoate IUPAC Name: zinc 4-(heptoxycarbonylamino)-2-hydroxybenzoate Traditional Name: zinc 4-(heptoxycarbonylamino)-2-hydroxy-benzoate Formula: C30H40N2O10Zn MolecularWeight: 654.055

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)NC1=CC(=C(C=C1)C(=O)[O-])O.CCCCCCCOC(=O)NC1=CC(=C(C=C1)C(=O)[O-])O.[Zn+2]

Isomeric SMILES

CCCCCCCOC(=O)NC1=CC(=C(C=C1)C(=O)[O-])O.CCCCCCCOC(=O)NC1=CC(=C(C=C1)C(=O)[O-])O.[Zn+2]

InChI

InChI=1S/2C15H21NO5.Zn/c2*1-2-3-4-5-6-9-21-15(20)16-11-7-8-12(14(18)19)13(17)10-11;/h2*7-8,10,17H,2-6,9H2,1H3,(H,16,20)(H,18,19);/q;;+2/p-2