3-[3-[(2-methoxy-4-methoxycarbonyl-phenyl)methyl]-1-propyl-indol-5-yl]propanoic acid

Systemtic Name: 3-[3-[(2-methoxy-4-methoxycarbonyl-phenyl)methyl]-1-propyl-indol-5-yl]propanoic acid Openeye Name: 3-[3-[(2-methoxy-4-methoxycarbonyl-phenyl)methyl]-1-propyl-indol-5-yl]propanoic acid CAS Name: 3-[3-[(2-methoxy-4-methoxycarbonylphenyl)methyl]-1-propyl-5-indolyl]propanoic acid IUPAC Name: 3-[3-[(2-methoxy-4-methoxycarbonylphenyl)methyl]-1-propylindol-5-yl]propanoic acid Traditional Name: 3-[3-(4-carbomethoxy-2-methoxy-benzyl)-1-propyl-indol-5-yl]propionic acid Formula: C24H27NO5 MolecularWeight: 409.47488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=C1C=CC(=C2)CCC(=O)O)CC3=C(C=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CCCN1C=C(C2=C1C=CC(=C2)CCC(=O)O)CC3=C(C=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C24H27NO5/c1-4-11-25-15-19(20-12-16(5-9-21(20)25)6-10-23(26)27)13-17-7-8-18(24(28)30-3)14-22(17)29-2/h5,7-9,12,14-15H,4,6,10-11,13H2,1-3H3,(H,26,27)