[6-methyl-2-(phosphonomethyl)-2-azoniaspiro[2.5]octa-5,7-dien-2-yl]methylphosphonic acid

Systemtic Name: [6-methyl-2-(phosphonomethyl)-2-azoniaspiro[2.5]octa-5,7-dien-2-yl]methylphosphonic acid Openeye Name: [6-methyl-2-(phosphonomethyl)-2-azoniaspiro[2.5]octa-5,7-dien-2-yl]methylphosphonic acid CAS Name: [6-methyl-2-(phosphonomethyl)-2-azoniaspiro[2.5]octa-5,7-dien-2-yl]methylphosphonic acid IUPAC Name: [6-methyl-2-(phosphonomethyl)-2-azoniaspiro[2.5]octa-5,7-dien-2-yl]methylphosphonic acid Traditional Name: [6-methyl-2-(phosphonomethyl)-2-azoniaspiro[2.5]octa-5,7-dien-2-yl]methylphosphonic acid Formula: C10H18NO6P2+ MolecularWeight: 310.200542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2(C[N+]2(CP(=O)(O)O)CP(=O)(O)O)C=C1

Isomeric SMILES

CC1=CCC2(C[N+]2(CP(=O)(O)O)CP(=O)(O)O)C=C1

InChI

InChI=1S/C10H17NO6P2/c1-9-2-4-10(5-3-9)6-11(10,7-18(12,13)14)8-19(15,16)17/h2-4H,5-8H2,1H3,(H3-,12,13,14,15,16,17)/p+1