3-[4-[4-(1-azanyl-2,3-dihydro-1H-inden-5-yl)-1-methyl-imidazol-2-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[4-(1-azanyl-2,3-dihydro-1H-inden-5-yl)-1-methyl-imidazol-2-yl]phenyl]propanoic acid Openeye Name: 3-[4-[4-(1-aminoindan-5-yl)-1-methyl-imidazol-2-yl]phenyl]propanoic acid CAS Name: 3-[4-[4-(1-amino-2,3-dihydro-1H-inden-5-yl)-1-methyl-2-imidazolyl]phenyl]propanoic acid IUPAC Name: 3-[4-[4-(1-amino-2,3-dihydro-1H-inden-5-yl)-1-methylimidazol-2-yl]phenyl]propanoic acid Traditional Name: 3-[4-[4-(1-aminoindan-5-yl)-1-methyl-imidazol-2-yl]phenyl]propionic acid Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C2=CC=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)C(CC4)N

Isomeric SMILES

CN1C=C(N=C1C2=CC=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)C(CC4)N

InChI

InChI=1S/C22H23N3O2/c1-25-13-20(17-7-9-18-16(12-17)8-10-19(18)23)24-22(25)15-5-2-14(3-6-15)4-11-21(26)27/h2-3,5-7,9,12-13,19H,4,8,10-11,23H2,1H3,(H,26,27)