2-[1-[(4-chlorophenyl)methyl]-2-(2-ethoxy-2-oxidanylidene-ethyl)-5-methoxy-indol-3-yl]propanoic acid

Systemtic Name: 2-[1-[(4-chlorophenyl)methyl]-2-(2-ethoxy-2-oxidanylidene-ethyl)-5-methoxy-indol-3-yl]propanoic acid Openeye Name: 2-[1-[(4-chlorophenyl)methyl]-2-(2-ethoxy-2-oxo-ethyl)-5-methoxy-indol-3-yl]propanoic acid CAS Name: 2-[1-[(4-chlorophenyl)methyl]-2-(2-ethoxy-2-oxoethyl)-5-methoxy-3-indolyl]propanoic acid IUPAC Name: 2-[1-[(4-chlorophenyl)methyl]-2-(2-ethoxy-2-oxoethyl)-5-methoxyindol-3-yl]propanoic acid Traditional Name: 2-[1-(4-chlorobenzyl)-2-(2-ethoxy-2-keto-ethyl)-5-methoxy-indol-3-yl]propionic acid Formula: C23H24ClNO5 MolecularWeight: 429.89336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C2=C(N1CC3=CC=C(C=C3)Cl)C=CC(=C2)OC)C(C)C(=O)O

Isomeric SMILES

CCOC(=O)CC1=C(C2=C(N1CC3=CC=C(C=C3)Cl)C=CC(=C2)OC)C(C)C(=O)O

InChI

InChI=1S/C23H24ClNO5/c1-4-30-21(26)12-20-22(14(2)23(27)28)18-11-17(29-3)9-10-19(18)25(20)13-15-5-7-16(24)8-6-15/h5-11,14H,4,12-13H2,1-3H3,(H,27,28)