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

Systemtic Name: propan-2-yl 2-[3-[4-(1H-indol-3-ylcarbonyl)piperazin-1-yl]phenoxy]-2-methyl-propanoate Openeye Name: isopropyl 2-[3-[4-(1H-indole-3-carbonyl)piperazin-1-yl]phenoxy]-2-methyl-propanoate CAS Name: 2-[3-[4-[1H-indol-3-yl(oxo)methyl]-1-piperazinyl]phenoxy]-2-methylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[3-[4-(1H-indole-3-carbonyl)piperazin-1-yl]phenoxy]-2-methylpropanoate Traditional Name: 2-[3-[4-(1H-indole-3-carbonyl)piperazino]phenoxy]-2-methyl-propionic acid isopropyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C)(C)OC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)OC(=O)C(C)(C)OC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C26H31N3O4/c1-18(2)32-25(31)26(3,4)33-20-9-7-8-19(16-20)28-12-14-29(15-13-28)24(30)22-17-27-23-11-6-5-10-21(22)23/h5-11,16-18,27H,12-15H2,1-4H3