2-[4-[(4-tert-butylphenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid

Systemtic Name: 2-[4-[(4-tert-butylphenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid Openeye Name: 2-[4-[(4-tert-butylphenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid CAS Name: 2-[4-[(4-tert-butylphenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid IUPAC Name: 2-[4-[(4-tert-butylphenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid Traditional Name: 2-[4-(4-tert-butylbenzyl)oxy-3-(1H-indol-5-yl)phenyl]propionic acid Formula: C28H29NO3 MolecularWeight: 427.53476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OCC2=CC=C(C=C2)C(C)(C)C)C3=CC4=C(C=C3)NC=C4)C(=O)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)OCC2=CC=C(C=C2)C(C)(C)C)C3=CC4=C(C=C3)NC=C4)C(=O)O

InChI

InChI=1S/C28H29NO3/c1-18(27(30)31)20-8-12-26(32-17-19-5-9-23(10-6-19)28(2,3)4)24(16-20)21-7-11-25-22(15-21)13-14-29-25/h5-16,18,29H,17H2,1-4H3,(H,30,31)