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

Systemtic Name: 3-methyl-3-[4-[4-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]butoxy]phenyl]butanoic acid Openeye Name: 3-methyl-3-[4-[4-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]butoxy]phenyl]butanoic acid CAS Name: 3-methyl-3-[4-[4-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]butoxy]phenyl]butanoic acid IUPAC Name: 3-methyl-3-[4-[4-[(3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]butoxy]phenyl]butanoic acid Traditional Name: 3-methyl-3-[4-[4-(3-phenyl-7-propyl-indoxazen-6-yl)oxybutoxy]phenyl]butyric acid Formula: C31H35NO5 MolecularWeight: 501.6133

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1ON=C2C3=CC=CC=C3)OCCCCOC4=CC=C(C=C4)C(C)(C)CC(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1ON=C2C3=CC=CC=C3)OCCCCOC4=CC=C(C=C4)C(C)(C)CC(=O)O

InChI

InChI=1S/C31H35NO5/c1-4-10-25-27(18-17-26-29(32-37-30(25)26)22-11-6-5-7-12-22)36-20-9-8-19-35-24-15-13-23(14-16-24)31(2,3)21-28(33)34/h5-7,11-18H,4,8-10,19-21H2,1-3H3,(H,33,34)