ethyl (2R)-2-(benzotriazol-1-yl)-2-[2-(phenylmethoxycarbonylamino)ethanoylamino]ethanoate

Systemtic Name: ethyl (2R)-2-(benzotriazol-1-yl)-2-[2-(phenylmethoxycarbonylamino)ethanoylamino]ethanoate Openeye Name: ethyl (2R)-2-(benzotriazol-1-yl)-2-[[2-(benzyloxycarbonylamino)acetyl]amino]acetate CAS Name: (2R)-2-(1-benzotriazolyl)-2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl (2R)-2-(benzotriazol-1-yl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetate Traditional Name: (2R)-2-(benzotriazol-1-yl)-2-[[2-(benzyloxycarbonylamino)acetyl]amino]acetic acid ethyl ester Formula: C20H21N5O5 MolecularWeight: 411.41124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(NC(=O)CNC(=O)OCC1=CC=CC=C1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCOC(=O)[C@H](NC(=O)CNC(=O)OCC1=CC=CC=C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H21N5O5/c1-2-29-19(27)18(25-16-11-7-6-10-15(16)23-24-25)22-17(26)12-21-20(28)30-13-14-8-4-3-5-9-14/h3-11,18H,2,12-13H2,1H3,(H,21,28)(H,22,26)/t18-/m1/s1