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

Systemtic Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-ethylindol-5-yl)phenyl]propanoic acid Openeye Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-ethylindol-5-yl)phenyl]propanoic acid CAS Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-ethyl-5-indolyl)phenyl]propanoic acid IUPAC Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-ethylindol-5-yl)phenyl]propanoic acid Traditional Name: 3-[4-[2-(4-dimethylaminophenyl)ethoxy]-3-(1-ethylindol-5-yl)phenyl]propionic acid Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC2=C1C=CC(=C2)C3=C(C=CC(=C3)CCC(=O)O)OCCC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCN1C=CC2=C1C=CC(=C2)C3=C(C=CC(=C3)CCC(=O)O)OCCC4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C29H32N2O3/c1-4-31-17-15-24-20-23(9-12-27(24)31)26-19-22(8-14-29(32)33)7-13-28(26)34-18-16-21-5-10-25(11-6-21)30(2)3/h5-7,9-13,15,17,19-20H,4,8,14,16,18H2,1-3H3,(H,32,33)