2-[2-[4-(1H-indol-3-ylcarbonyl)piperazin-1-yl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[2-[4-(1H-indol-3-ylcarbonyl)piperazin-1-yl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[2-[4-(1H-indole-3-carbonyl)piperazin-1-yl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[2-[4-[1H-indol-3-yl(oxo)methyl]-1-piperazinyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[2-[4-(1H-indole-3-carbonyl)piperazin-1-yl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[2-[4-(1H-indole-3-carbonyl)piperazino]phenoxy]-2-methyl-propionic acid Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C23H25N3O4/c1-23(2,22(28)29)30-20-10-6-5-9-19(20)25-11-13-26(14-12-25)21(27)17-15-24-18-8-4-3-7-16(17)18/h3-10,15,24H,11-14H2,1-2H3,(H,28,29)