2-[1-[4-(2-imidazol-1-ylethoxy)phenyl]carbonyl-2-methyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[1-[4-(2-imidazol-1-ylethoxy)phenyl]carbonyl-2-methyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-[4-(2-imidazol-1-ylethoxy)benzoyl]-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[1-[[4-[2-(1-imidazolyl)ethoxy]phenyl]-oxomethyl]-2-methyl-4-indolyl]acetic acid IUPAC Name: 2-[1-[4-(2-imidazol-1-ylethoxy)benzoyl]-2-methylindol-4-yl]acetic acid Traditional Name: 2-[1-[4-(2-imidazol-1-ylethoxy)benzoyl]-2-methyl-indol-4-yl]acetic acid Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCN4C=CN=C4)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCN4C=CN=C4)CC(=O)O

InChI

InChI=1S/C23H21N3O4/c1-16-13-20-18(14-22(27)28)3-2-4-21(20)26(16)23(29)17-5-7-19(8-6-17)30-12-11-25-10-9-24-15-25/h2-10,13,15H,11-12,14H2,1H3,(H,27,28)