[4-(2-methyl-4-phenyl-phenyl)-1-phosphono-butyl]phosphonic acid

Systemtic Name: [4-(2-methyl-4-phenyl-phenyl)-1-phosphono-butyl]phosphonic acid Openeye Name: [4-(2-methyl-4-phenyl-phenyl)-1-phosphono-butyl]phosphonic acid CAS Name: [4-(2-methyl-4-phenylphenyl)-1-phosphonobutyl]phosphonic acid IUPAC Name: [4-(2-methyl-4-phenylphenyl)-1-phosphonobutyl]phosphonic acid Traditional Name: [4-(2-methyl-4-phenyl-phenyl)-1-phosphono-butyl]phosphonic acid Formula: C17H22O6P2 MolecularWeight: 384.300502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC=CC=C2)CCCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC=CC=C2)CCCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C17H22O6P2/c1-13-12-16(15-6-3-2-4-7-15)11-10-14(13)8-5-9-17(24(18,19)20)25(21,22)23/h2-4,6-7,10-12,17H,5,8-9H2,1H3,(H2,18,19,20)(H2,21,22,23)