2-[[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-phenyl-amino]ethanoic acid

Systemtic Name: 2-[[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-phenyl-amino]ethanoic acid Openeye Name: 2-(N-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]anilino)acetic acid CAS Name: 2-(N-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]anilino)acetic acid IUPAC Name: 2-(N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]anilino)acetic acid Traditional Name: 2-(N-[2-(4-benzylpiperazino)-2-keto-ethyl]anilino)acetic 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)CN(CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN(CC(=O)O)C3=CC=CC=C3

InChI

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