2-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamoylamino]-3-phenyl-propanoic acid CAS Name: 2-[[[4-(4-ethyl-1-piperazinyl)anilino]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamoylamino]-3-phenylpropanoic acid Traditional Name: 2-[[4-(4-ethylpiperazino)phenyl]carbamoylamino]-3-phenyl-propionic acid Formula: C22H28N4O3 MolecularWeight: 396.48272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H28N4O3/c1-2-25-12-14-26(15-13-25)19-10-8-18(9-11-19)23-22(29)24-20(21(27)28)16-17-6-4-3-5-7-17/h3-11,20H,2,12-16H2,1H3,(H,27,28)(H2,23,24,29)