[[(3-fluoranyl-4-methyl-phenyl)amino]-(4-propan-2-ylphenyl)methyl]phosphonic acid; propan-2-ol

Systemtic Name: [[(3-fluoranyl-4-methyl-phenyl)amino]-(4-propan-2-ylphenyl)methyl]phosphonic acid; propan-2-ol Openeye Name: [(3-fluoro-4-methyl-anilino)-(4-isopropylphenyl)methyl]phosphonic acid; propan-2-ol CAS Name: [(3-fluoro-4-methylanilino)-(4-propan-2-ylphenyl)methyl]phosphonic acid; 2-propanol IUPAC Name: [(3-fluoro-4-methylanilino)-(4-propan-2-ylphenyl)methyl]phosphonic acid; propan-2-ol Traditional Name: [(3-fluoro-4-methyl-anilino)-p-cumenyl-methyl]phosphonic acid; propan-2-ol Formula: C20H29FNO4P MolecularWeight: 397.420724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(C2=CC=C(C=C2)C(C)C)P(=O)(O)O)F.CC(C)O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(C2=CC=C(C=C2)C(C)C)P(=O)(O)O)F.CC(C)O

InChI

InChI=1S/C17H21FNO3P.C3H8O/c1-11(2)13-5-7-14(8-6-13)17(23(20,21)22)19-15-9-4-12(3)16(18)10-15;1-3(2)4/h4-11,17,19H,1-3H3,(H2,20,21,22);3-4H,1-2H3