(3S)-5-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-methyl-5-oxidanylidene-pentanoate

Systemtic Name: (3S)-5-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-methyl-5-oxidanylidene-pentanoate Openeye Name: (3S)-5-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-methyl-5-oxo-pentanoate CAS Name: (3S)-5-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-3-methyl-5-oxopentanoate IUPAC Name: (3S)-5-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-methyl-5-oxopentanoate Traditional Name: (3S)-5-[4-(4-chlorobenzyl)piperazino]-5-keto-3-methyl-valerate Formula: C17H22ClN2O3- MolecularWeight: 337.82118

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCN(CC1)CC2=CC=C(C=C2)Cl)CC(=O)[O-]

Isomeric SMILES

C[C@@H](CC(=O)N1CCN(CC1)CC2=CC=C(C=C2)Cl)CC(=O)[O-]

InChI

InChI=1S/C17H23ClN2O3/c1-13(11-17(22)23)10-16(21)20-8-6-19(7-9-20)12-14-2-4-15(18)5-3-14/h2-5,13H,6-12H2,1H3,(H,22,23)/p-1/t13-/m0/s1