3-phenyl-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]propanoic acid hydrochloride

Systemtic Name: 3-phenyl-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]propanoic acid hydrochloride Openeye Name: 3-phenyl-3-[6-[3-(2-pyridylamino)propoxy]-1H-indol-3-yl]propanoic acid hydrochloride CAS Name: 3-phenyl-3-[6-[3-(2-pyridinylamino)propoxy]-1H-indol-3-yl]propanoic acid hydrochloride IUPAC Name: 3-phenyl-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]propanoic acid hydrochloride Traditional Name: 3-phenyl-3-[6-[3-(2-pyridylamino)propoxy]-1H-indol-3-yl]propionic acid hydrochloride Formula: C25H26ClN3O3 MolecularWeight: 451.94524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)C2=CNC3=C2C=CC(=C3)OCCCNC4=CC=CC=N4.Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)C2=CNC3=C2C=CC(=C3)OCCCNC4=CC=CC=N4.Cl

InChI

InChI=1S/C25H25N3O3.ClH/c29-25(30)16-21(18-7-2-1-3-8-18)22-17-28-23-15-19(10-11-20(22)23)31-14-6-13-27-24-9-4-5-12-26-24;/h1-5,7-12,15,17,21,28H,6,13-14,16H2,(H,26,27)(H,29,30);1H