3-phenyl-2-[[4-(phenylmethyl)piperazin-1-yl]carbonylamino]propanoic acid

Systemtic Name: 3-phenyl-2-[[4-(phenylmethyl)piperazin-1-yl]carbonylamino]propanoic acid Openeye Name: 2-[(4-benzylpiperazine-1-carbonyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(4-benzylpiperazine-1-carbonyl)amino]-3-phenylpropanoic acid Traditional Name: 2-[(4-benzylpiperazine-1-carbonyl)amino]-3-phenyl-propionic acid Formula: C21H25N3O3 MolecularWeight: 367.4415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H25N3O3/c25-20(26)19(15-17-7-3-1-4-8-17)22-21(27)24-13-11-23(12-14-24)16-18-9-5-2-6-10-18/h1-10,19H,11-16H2,(H,22,27)(H,25,26)