methyl (2R)-2-[[(2R)-4-(4-dimethylaminophenyl)carbonyl-1-ethanoyl-piperazin-2-yl]carbonylamino]propanoate

Systemtic Name: methyl (2R)-2-[[(2R)-4-(4-dimethylaminophenyl)carbonyl-1-ethanoyl-piperazin-2-yl]carbonylamino]propanoate Openeye Name: methyl (2R)-2-[[(2R)-1-acetyl-4-[4-(dimethylamino)benzoyl]piperazine-2-carbonyl]amino]propanoate CAS Name: (2R)-2-[[[(2R)-1-acetyl-4-[(4-dimethylaminophenyl)-oxomethyl]-2-piperazinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2R)-1-acetyl-4-[4-(dimethylamino)benzoyl]piperazine-2-carbonyl]amino]propanoate Traditional Name: (2R)-2-[[(2R)-1-acetyl-4-[4-(dimethylamino)benzoyl]piperazine-2-carbonyl]amino]propionic acid methyl ester Formula: C20H28N4O5 MolecularWeight: 404.46012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C1CN(CCN1C(=O)C)C(=O)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

C[C@H](C(=O)OC)NC(=O)[C@H]1CN(CCN1C(=O)C)C(=O)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C20H28N4O5/c1-13(20(28)29-5)21-18(26)17-12-23(10-11-24(17)14(2)25)19(27)15-6-8-16(9-7-15)22(3)4/h6-9,13,17H,10-12H2,1-5H3,(H,21,26)/t13-,17-/m1/s1