4-[4-[3-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]propoxy]phenyl]butanoic acid

Systemtic Name: 4-[4-[3-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]propoxy]phenyl]butanoic acid Openeye Name: 4-[4-[3-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]propoxy]phenyl]butanoic acid CAS Name: 4-[4-[3-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]propoxy]phenyl]butanoic acid IUPAC Name: 4-[4-[3-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]propoxy]phenyl]butanoic acid Traditional Name: 4-[4-[3-(3-phenyl-7-propyl-indoxazen-6-yl)oxypropoxy]phenyl]butyric acid Formula: C29H31NO5 MolecularWeight: 473.56014

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1ON=C2C3=CC=CC=C3)OCCCOC4=CC=C(C=C4)CCCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1ON=C2C3=CC=CC=C3)OCCCOC4=CC=C(C=C4)CCCC(=O)O

InChI

InChI=1S/C29H31NO5/c1-2-8-24-26(18-17-25-28(30-35-29(24)25)22-10-4-3-5-11-22)34-20-7-19-33-23-15-13-21(14-16-23)9-6-12-27(31)32/h3-5,10-11,13-18H,2,6-9,12,19-20H2,1H3,(H,31,32)