3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-methylindol-5-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-methylindol-5-yl)phenyl]propanoic acid Openeye Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-methylindol-5-yl)phenyl]propanoic acid CAS Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-methyl-5-indolyl)phenyl]propanoic acid IUPAC Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-methylindol-5-yl)phenyl]propanoic acid Traditional Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-methylindol-5-yl)phenyl]propionic acid Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)C3=C(C=CC(=C3)CCC(=O)O)OCCC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)C3=C(C=CC(=C3)CCC(=O)O)OCCC4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C28H30N2O3/c1-29(2)24-9-4-20(5-10-24)15-17-33-27-12-6-21(7-13-28(31)32)18-25(27)22-8-11-26-23(19-22)14-16-30(26)3/h4-6,8-12,14,16,18-19H,7,13,15,17H2,1-3H3,(H,31,32)