2-[2-(3-ethoxy-4-phenylmethoxy-phenyl)-5-propan-2-yl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3-ethoxy-4-phenylmethoxy-phenyl)-5-propan-2-yl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-benzyloxy-3-ethoxy-phenyl)-5-isopropyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3-ethoxy-4-phenylmethoxyphenyl)-5-propan-2-yl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3-ethoxy-4-phenylmethoxyphenyl)-5-propan-2-yl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-benzoxy-3-ethoxy-phenyl)-5-isopropyl-1H-indol-3-yl]acetic acid Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)C)CC(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)C)CC(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H29NO4/c1-4-32-26-15-21(11-13-25(26)33-17-19-8-6-5-7-9-19)28-23(16-27(30)31)22-14-20(18(2)3)10-12-24(22)29-28/h5-15,18,29H,4,16-17H2,1-3H3,(H,30,31)