methyl 2-[4-[2-(3-methylphenyl)ethanoyl]-2-oxidanylidene-3-(2-oxidanyl-3-phenoxy-propyl)piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[2-(3-methylphenyl)ethanoyl]-2-oxidanylidene-3-(2-oxidanyl-3-phenoxy-propyl)piperazin-1-yl]ethanoate Openeye Name: methyl 2-[3-(2-hydroxy-3-phenoxy-propyl)-4-[2-(m-tolyl)acetyl]-2-oxo-piperazin-1-yl]acetate CAS Name: 2-[3-(2-hydroxy-3-phenoxypropyl)-4-[2-(3-methylphenyl)-1-oxoethyl]-2-oxo-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(2-hydroxy-3-phenoxypropyl)-4-[2-(3-methylphenyl)acetyl]-2-oxopiperazin-1-yl]acetate Traditional Name: 2-[3-(2-hydroxy-3-phenoxy-propyl)-2-keto-4-[2-(m-tolyl)acetyl]piperazino]acetic acid methyl ester Formula: C25H30N2O6 MolecularWeight: 454.5155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(=O)N2CCN(C(=O)C2CC(COC3=CC=CC=C3)O)CC(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)CC(=O)N2CCN(C(=O)C2CC(COC3=CC=CC=C3)O)CC(=O)OC

InChI

InChI=1S/C25H30N2O6/c1-18-7-6-8-19(13-18)14-23(29)27-12-11-26(16-24(30)32-2)25(31)22(27)15-20(28)17-33-21-9-4-3-5-10-21/h3-10,13,20,22,28H,11-12,14-17H2,1-2H3