4-heptoxy-2-[4-(4-nonoxyphenyl)phenyl]benzoic acid

Systemtic Name: 4-heptoxy-2-[4-(4-nonoxyphenyl)phenyl]benzoic acid Openeye Name: 4-heptoxy-2-[4-(4-nonoxyphenyl)phenyl]benzoic acid CAS Name: 4-heptoxy-2-[4-(4-nonoxyphenyl)phenyl]benzoic acid IUPAC Name: 4-heptoxy-2-[4-(4-nonoxyphenyl)phenyl]benzoic acid Traditional Name: 4-heptoxy-2-[4-(4-nonoxyphenyl)phenyl]benzoic acid Formula: C35H46O4 MolecularWeight: 530.73734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(C=CC(=C3)OCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(C=CC(=C3)OCCCCCCC)C(=O)O

InChI

InChI=1S/C35H46O4/c1-3-5-7-9-10-12-14-25-38-31-21-19-29(20-22-31)28-15-17-30(18-16-28)34-27-32(23-24-33(34)35(36)37)39-26-13-11-8-6-4-2/h15-24,27H,3-14,25-26H2,1-2H3,(H,36,37)