4-[2-[2-(phenylmethoxycarbonylamino)propoxy]phenyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[2-[2-(phenylmethoxycarbonylamino)propoxy]phenyl]piperazine-1-carboxylic acid Openeye Name: 4-[2-[2-(benzyloxycarbonylamino)propoxy]phenyl]piperazine-1-carboxylic acid CAS Name: 4-[2-[2-(phenylmethoxycarbonylamino)propoxy]phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[2-[2-(phenylmethoxycarbonylamino)propoxy]phenyl]piperazine-1-carboxylic acid Traditional Name: 4-[2-[2-(benzyloxycarbonylamino)propoxy]phenyl]piperazine-1-carboxylic acid Formula: C22H27N3O5 MolecularWeight: 413.46688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1N2CCN(CC2)C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(COC1=CC=CC=C1N2CCN(CC2)C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O5/c1-17(23-21(26)30-16-18-7-3-2-4-8-18)15-29-20-10-6-5-9-19(20)24-11-13-25(14-12-24)22(27)28/h2-10,17H,11-16H2,1H3,(H,23,26)(H,27,28)