3-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[4-(4-heptoxyphenyl)phenyl]pentanoic acid

Systemtic Name: 3-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[4-(4-heptoxyphenyl)phenyl]pentanoic acid Openeye Name: 3-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[4-(4-heptoxyphenyl)phenyl]pentanoic acid CAS Name: 3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-[4-(4-heptoxyphenyl)phenyl]pentanoic acid IUPAC Name: 3-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[4-(4-heptoxyphenyl)phenyl]pentanoic acid Traditional Name: 3-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[4-(4-heptoxyphenyl)phenyl]valeric acid Formula: C39H43NO5 MolecularWeight: 605.76242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)CCC(CC(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)CCC(CC(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C39H43NO5/c1-2-3-4-5-10-25-44-32-23-20-30(21-24-32)29-18-15-28(16-19-29)17-22-31(26-38(41)42)40-39(43)45-27-37-35-13-8-6-11-33(35)34-12-7-9-14-36(34)37/h6-9,11-16,18-21,23-24,31,37H,2-5,10,17,22,25-27H2,1H3,(H,40,43)(H,41,42)