(phenylmethyl) 2-[3-oxidanylidene-1-(3-propoxyphenyl)carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-oxidanylidene-1-(3-propoxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: benzyl 2-[3-oxo-1-(3-propoxybenzoyl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-(3-propoxyphenyl)methyl]-2-piperazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-oxo-1-(3-propoxybenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(3-propoxybenzoyl)piperazin-2-yl]acetic acid benzyl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)N2CCNC(=O)C2CC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)N2CCNC(=O)C2CC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H26N2O5/c1-2-13-29-19-10-6-9-18(14-19)23(28)25-12-11-24-22(27)20(25)15-21(26)30-16-17-7-4-3-5-8-17/h3-10,14,20H,2,11-13,15-16H2,1H3,(H,24,27)