ethyl 5-[[2-[(2R)-3-oxidanylidene-1-(phenylmethyl)piperazin-2-yl]ethanoylamino]methyl]furan-2-carboxylate

Systemtic Name: ethyl 5-[[2-[(2R)-3-oxidanylidene-1-(phenylmethyl)piperazin-2-yl]ethanoylamino]methyl]furan-2-carboxylate Openeye Name: ethyl 5-[[[2-[(2R)-1-benzyl-3-oxo-piperazin-2-yl]acetyl]amino]methyl]furan-2-carboxylate CAS Name: 5-[[[1-oxo-2-[(2R)-3-oxo-1-(phenylmethyl)-2-piperazinyl]ethyl]amino]methyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[[2-[(2R)-1-benzyl-3-oxopiperazin-2-yl]acetyl]amino]methyl]furan-2-carboxylate Traditional Name: 5-[[[2-[(2R)-1-benzyl-3-keto-piperazin-2-yl]acetyl]amino]methyl]furan-2-carboxylic acid ethyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)CNC(=O)CC2C(=O)NCCN2CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)CNC(=O)C[C@@H]2C(=O)NCCN2CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O5/c1-2-28-21(27)18-9-8-16(29-18)13-23-19(25)12-17-20(26)22-10-11-24(17)14-15-6-4-3-5-7-15/h3-9,17H,2,10-14H2,1H3,(H,22,26)(H,23,25)/t17-/m1/s1