Basic Information |
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Product Name: | CALCIUM BIS[4-[[1-[[(2-CHLOROPHENYL)AMINO]CARBONYL]-2-OXOPROPYL]AZO]-3-NITROBENZENESULPHONATE] |
CAS: | 71832-85-4 |
English Synonyms: | CALCIUM BIS[4-[[1-[[(2-CHLOROPHENYL)AMINO]CARBONYL]-2-OXOPROPYL]AZO]-3-NITROBENZENESULPHONATE] |
MDL Number.: | MFCD23160569 |
H bond acceptor: | 11 |
H bond donor: | 1 |
Smile: | CC(=O)C(C(=O)Nc1ccccc1Cl)/N=N/c2ccc(cc2[N+](=O)[O-])S(=O)(=O)[O-].CC(=O)C(C(=O)Nc1ccccc1Cl)/N=N/c2ccc(cc2[N+](=O)[O-])S(=O)(=O)[O-].[Ca+2] |
InChi: | InChI=1S/2C16H13ClN4O7S.Ca/c2*1-9(22)15(16(23)18-12-5-3-2-4-11(12)17)20-19-13-7-6-10(29(26,27)28)8-14(13)21(24)25;/h2*2-8,15H,1H3,(H,18,23)(H,26,27,28);/q;;+2/p-2/b2*20-19+; |
InChiKey: | InChIKey=VAIFZRVTOUVLAW-FFRZOONGSA-L |
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