2-[[2-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]carbamoylamino]propanoic acid

Systemtic Name: 2-[[2-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]carbamoylamino]propanoic acid Openeye Name: 2-[[2-(4-benzoylpiperazin-1-yl)phenyl]carbamoylamino]propanoic acid CAS Name: 2-[[[2-(4-benzoyl-1-piperazinyl)anilino]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[2-(4-benzoylpiperazin-1-yl)phenyl]carbamoylamino]propanoic acid Traditional Name: 2-[[2-(4-benzoylpiperazino)phenyl]carbamoylamino]propionic acid Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)NC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)O)NC(=O)NC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O4/c1-15(20(27)28)22-21(29)23-17-9-5-6-10-18(17)24-11-13-25(14-12-24)19(26)16-7-3-2-4-8-16/h2-10,15H,11-14H2,1H3,(H,27,28)(H2,22,23,29)