4-[2,6-bis(4-methoxyphenyl)-4-(7-phenylheptylcarbamoyl)phenoxy]butanoic acid

Systemtic Name: 4-[2,6-bis(4-methoxyphenyl)-4-(7-phenylheptylcarbamoyl)phenoxy]butanoic acid Openeye Name: 4-[2,6-bis(4-methoxyphenyl)-4-(7-phenylheptylcarbamoyl)phenoxy]butanoic acid CAS Name: 4-[2,6-bis(4-methoxyphenyl)-4-[oxo-(7-phenylheptylamino)methyl]phenoxy]butanoic acid IUPAC Name: 4-[2,6-bis(4-methoxyphenyl)-4-(7-phenylheptylcarbamoyl)phenoxy]butanoic acid Traditional Name: 4-[2,6-bis(4-methoxyphenyl)-4-(7-phenylheptylcarbamoyl)phenoxy]butyric acid Formula: C38H43NO6 MolecularWeight: 609.75112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=CC(=C2OCCCC(=O)O)C3=CC=C(C=C3)OC)C(=O)NCCCCCCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=CC(=C2OCCCC(=O)O)C3=CC=C(C=C3)OC)C(=O)NCCCCCCCC4=CC=CC=C4

InChI

InChI=1S/C38H43NO6/c1-43-32-20-16-29(17-21-32)34-26-31(38(42)39-24-10-5-3-4-7-12-28-13-8-6-9-14-28)27-35(30-18-22-33(44-2)23-19-30)37(34)45-25-11-15-36(40)41/h6,8-9,13-14,16-23,26-27H,3-5,7,10-12,15,24-25H2,1-2H3,(H,39,42)(H,40,41)