3-[5-cyclohexyl-3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]propanoic acid

Systemtic Name: 3-[5-cyclohexyl-3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]propanoic acid Openeye Name: 3-[5-cyclohexyl-3-(2-imidazol-1-ylethyl)indolin-1-yl]propanoic acid CAS Name: 3-[5-cyclohexyl-3-[2-(1-imidazolyl)ethyl]-2,3-dihydroindol-1-yl]propanoic acid IUPAC Name: 3-[5-cyclohexyl-3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]propanoic acid Traditional Name: 3-[5-cyclohexyl-3-(2-imidazol-1-ylethyl)indolin-1-yl]propionic acid Formula: C22H29N3O2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC3=C(C=C2)N(CC3CCN4C=CN=C4)CCC(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC3=C(C=C2)N(CC3CCN4C=CN=C4)CCC(=O)O

InChI

InChI=1S/C22H29N3O2/c26-22(27)9-12-25-15-19(8-11-24-13-10-23-16-24)20-14-18(6-7-21(20)25)17-4-2-1-3-5-17/h6-7,10,13-14,16-17,19H,1-5,8-9,11-12,15H2,(H,26,27)