Calcium iobenzamate

Molecular Formula: C₃₂H₂₄CaI₆N₄O₆

InChI: InChI=1/2C16H13I3N2O3.Ca/c2*17-10-8-11(18)15(20)14(19)13(10)16(24)21(7-6-12(22)23)9-4-2-1-3-5-9;/h2*1-5,8H,6-7,20H2,(H,22,23);/q;;+2/p-2/f2C16H12I3N2O3.Ca/q2*-1;m

InChIKey: InChIKey=OHWYOBDGJKRAOI-KVWUGYAJCM
SMILES: C1=CC=C(C=C1)N(CCC(=O)[O-])C(=O)C2=C(C(=C(C=C2I)I)N)I.C1=CC=C(C=C1)N(CCC(=O)[O-])C(=O)C2=C(C(=C(C=C2I)I)N)I.[Ca+2]

Names:
    beta-ALANINE, N-(3-AMINO-2,4,6-TRIIODOBENZOYL)-N-PHENYL-, CALCIUM SALT
    Calcium iobenzamate
    calcium 3-[(3-amino-2,4,6-triiodo-benzoyl)-phenyl-amino]propanoate
    N-(3-Amino-2,4,6-triiodobenzoyl)-N-phenyl-beta-alanine calcium salt
    N-(3-Amino-2,4,6-triiodobenzoyl)-N-phenyl-3-aminopropionic acid, calcium
    ST 5066/Ca [German]
    77966-96-2

Registries:
    PubChem CID 53966
    PubChem ID 191671