methyl 2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-5-methyl-benzoate

Systemtic Name: methyl 2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-5-methyl-benzoate Openeye Name: methyl 2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethoxy]-5-methyl-benzoate CAS Name: 2-[2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethoxy]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethoxy]-5-methylbenzoate Traditional Name: 2-[2-[4-(4-chlorobenzyl)piperazino]-2-keto-ethoxy]-5-methyl-benzoic acid methyl ester Formula: C22H25ClN2O4 MolecularWeight: 416.8979

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C22H25ClN2O4/c1-16-3-8-20(19(13-16)22(27)28-2)29-15-21(26)25-11-9-24(10-12-25)14-17-4-6-18(23)7-5-17/h3-8,13H,9-12,14-15H2,1-2H3