3-[6-[3-(4,5-dihydro-1H-imidazol-2-ylamino)propoxy]-1H-indol-3-yl]-3-phenyl-propanoic acid

Systemtic Name: 3-[6-[3-(4,5-dihydro-1H-imidazol-2-ylamino)propoxy]-1H-indol-3-yl]-3-phenyl-propanoic acid Openeye Name: 3-[6-[3-(4,5-dihydro-1H-imidazol-2-ylamino)propoxy]-1H-indol-3-yl]-3-phenyl-propanoic acid CAS Name: 3-[6-[3-(4,5-dihydro-1H-imidazol-2-ylamino)propoxy]-1H-indol-3-yl]-3-phenylpropanoic acid IUPAC Name: 3-[6-[3-(4,5-dihydro-1H-imidazol-2-ylamino)propoxy]-1H-indol-3-yl]-3-phenylpropanoic acid Traditional Name: 3-[6-[3-(2-imidazolin-2-ylamino)propoxy]-1H-indol-3-yl]-3-phenyl-propionic acid Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)NCCCOC2=CC3=C(C=C2)C(=CN3)C(CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1CN=C(N1)NCCCOC2=CC3=C(C=C2)C(=CN3)C(CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O3/c28-22(29)14-19(16-5-2-1-3-6-16)20-15-27-21-13-17(7-8-18(20)21)30-12-4-9-24-23-25-10-11-26-23/h1-3,5-8,13,15,19,27H,4,9-12,14H2,(H,28,29)(H2,24,25,26)