2-(2,6-dimethylphenyl)-2-[4-(2-oxidanyl-3-phenoxy-propyl)piperazin-1-yl]ethanamide

Systemtic Name: 2-(2,6-dimethylphenyl)-2-[4-(2-oxidanyl-3-phenoxy-propyl)piperazin-1-yl]ethanamide Openeye Name: 2-(2,6-dimethylphenyl)-2-[4-(2-hydroxy-3-phenoxy-propyl)piperazin-1-yl]acetamide CAS Name: 2-(2,6-dimethylphenyl)-2-[4-(2-hydroxy-3-phenoxypropyl)-1-piperazinyl]acetamide IUPAC Name: 2-(2,6-dimethylphenyl)-2-[4-(2-hydroxy-3-phenoxypropyl)piperazin-1-yl]acetamide Traditional Name: 2-(2,6-dimethylphenyl)-2-[4-(2-hydroxy-3-phenoxy-propyl)piperazino]acetamide Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(C(=O)N)N2CCN(CC2)CC(COC3=CC=CC=C3)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(C(=O)N)N2CCN(CC2)CC(COC3=CC=CC=C3)O

InChI

InChI=1S/C23H31N3O3/c1-17-7-6-8-18(2)21(17)22(23(24)28)26-13-11-25(12-14-26)15-19(27)16-29-20-9-4-3-5-10-20/h3-10,19,22,27H,11-16H2,1-2H3,(H2,24,28)