6-azanyl-2-[[3-phenyl-2-(4-phenylpiperazin-1-yl)propanoyl]amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[3-phenyl-2-(4-phenylpiperazin-1-yl)propanoyl]amino]hexanoic acid Openeye Name: 6-amino-2-[[3-phenyl-2-(4-phenylpiperazin-1-yl)propanoyl]amino]hexanoic acid CAS Name: 6-amino-2-[[1-oxo-3-phenyl-2-(4-phenyl-1-piperazinyl)propyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[3-phenyl-2-(4-phenylpiperazin-1-yl)propanoyl]amino]hexanoic acid Traditional Name: 6-amino-2-[[3-phenyl-2-(4-phenylpiperazino)propanoyl]amino]hexanoic acid Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(CC3=CC=CC=C3)C(=O)NC(CCCCN)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(CC3=CC=CC=C3)C(=O)NC(CCCCN)C(=O)O

InChI

InChI=1S/C25H34N4O3/c26-14-8-7-13-22(25(31)32)27-24(30)23(19-20-9-3-1-4-10-20)29-17-15-28(16-18-29)21-11-5-2-6-12-21/h1-6,9-12,22-23H,7-8,13-19,26H2,(H,27,30)(H,31,32)