3-(4-phenylphenyl)-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]propanoic acid

Systemtic Name: 3-(4-phenylphenyl)-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]propanoic acid Openeye Name: 3-(4-phenylphenyl)-3-[6-[3-(2-pyridylamino)propoxy]-1H-indol-3-yl]propanoic acid CAS Name: 3-(4-phenylphenyl)-3-[6-[3-(2-pyridinylamino)propoxy]-1H-indol-3-yl]propanoic acid IUPAC Name: 3-(4-phenylphenyl)-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]propanoic acid Traditional Name: 3-(4-phenylphenyl)-3-[6-[3-(2-pyridylamino)propoxy]-1H-indol-3-yl]propionic acid Formula: C31H29N3O3 MolecularWeight: 491.58026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(CC(=O)O)C3=CNC4=C3C=CC(=C4)OCCCNC5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(CC(=O)O)C3=CNC4=C3C=CC(=C4)OCCCNC5=CC=CC=N5

InChI

InChI=1S/C31H29N3O3/c35-31(36)20-27(24-12-10-23(11-13-24)22-7-2-1-3-8-22)28-21-34-29-19-25(14-15-26(28)29)37-18-6-17-33-30-9-4-5-16-32-30/h1-5,7-16,19,21,27,34H,6,17-18,20H2,(H,32,33)(H,35,36)