2-methyl-2-[3-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenoxy]propanoate

Systemtic Name: 2-methyl-2-[3-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenoxy]propanoate Openeye Name: 2-methyl-2-[3-[4-(4-methylbenzoyl)piperazin-1-yl]phenoxy]propanoate CAS Name: 2-methyl-2-[3-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenoxy]propanoate IUPAC Name: 2-methyl-2-[3-[4-(4-methylbenzoyl)piperazin-1-yl]phenoxy]propanoate Traditional Name: 2-methyl-2-[3-(4-p-toluoylpiperazino)phenoxy]propionate Formula: C22H25N2O4- MolecularWeight: 381.4449

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)OC(C)(C)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)OC(C)(C)C(=O)[O-]

InChI

InChI=1S/C22H26N2O4/c1-16-7-9-17(10-8-16)20(25)24-13-11-23(12-14-24)18-5-4-6-19(15-18)28-22(2,3)21(26)27/h4-10,15H,11-14H2,1-3H3,(H,26,27)/p-1