3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecakis(fluoranyl)decyl 3,5-bis(azanyl)benzoate

Systemtic Name: 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecakis(fluoranyl)decyl 3,5-bis(azanyl)benzoate Openeye Name: 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl 3,5-diaminobenzoate CAS Name: 3,5-diaminobenzoic acid 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl ester IUPAC Name: 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl 3,5-diaminobenzoate Traditional Name: 3,5-diaminobenzoic acid 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl ester Formula: C17H11F17N2O2 MolecularWeight: 598.254294

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1N)N)C(=O)OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

C1=C(C=C(C=C1N)N)C(=O)OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C17H11F17N2O2/c18-10(19,1-2-38-9(37)6-3-7(35)5-8(36)4-6)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)16(30,31)17(32,33)34/h3-5H,1-2,35-36H2