5-phenyl-3-[2-[(3-piperazin-1-ylphenyl)carbonylamino]ethanoylamino]pentanoic acid

Systemtic Name: 5-phenyl-3-[2-[(3-piperazin-1-ylphenyl)carbonylamino]ethanoylamino]pentanoic acid Openeye Name: 5-phenyl-3-[[2-[(3-piperazin-1-ylbenzoyl)amino]acetyl]amino]pentanoic acid CAS Name: 3-[[1-oxo-2-[[oxo-[3-(1-piperazinyl)phenyl]methyl]amino]ethyl]amino]-5-phenylpentanoic acid IUPAC Name: 5-phenyl-3-[[2-[(3-piperazin-1-ylbenzoyl)amino]acetyl]amino]pentanoic acid Traditional Name: 5-phenyl-3-[[2-[(3-piperazinobenzoyl)amino]acetyl]amino]valeric acid Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC(=C2)C(=O)NCC(=O)NC(CCC3=CC=CC=C3)CC(=O)O

Isomeric SMILES

C1CN(CCN1)C2=CC=CC(=C2)C(=O)NCC(=O)NC(CCC3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C24H30N4O4/c29-22(27-20(16-23(30)31)10-9-18-5-2-1-3-6-18)17-26-24(32)19-7-4-8-21(15-19)28-13-11-25-12-14-28/h1-8,15,20,25H,9-14,16-17H2,(H,26,32)(H,27,29)(H,30,31)