(phenylmethyl) 4-[(2-methylpropan-2-yl)oxy]-2-[[(2-oxidanylidenecyclopropyl)carbonyl-phenylazanyl-amino]methyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[(2-methylpropan-2-yl)oxy]-2-[[(2-oxidanylidenecyclopropyl)carbonyl-phenylazanyl-amino]methyl]piperazine-1-carboxylate Openeye Name: benzyl 2-[[anilino-(2-oxocyclopropanecarbonyl)amino]methyl]-4-tert-butoxy-piperazine-1-carboxylate CAS Name: 2-[[anilino-[oxo-(2-oxocyclopropyl)methyl]amino]methyl]-4-[(2-methylpropan-2-yl)oxy]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[anilino-(2-oxocyclopropanecarbonyl)amino]methyl]-4-[(2-methylpropan-2-yl)oxy]piperazine-1-carboxylate Traditional Name: 2-[[anilino-(2-ketocyclopropanecarbonyl)amino]methyl]-4-tert-butoxy-piperazine-1-carboxylic acid benzyl ester Formula: C27H34N4O5 MolecularWeight: 494.58266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)ON1CCN(C(C1)CN(C(=O)C2CC2=O)NC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)ON1CCN(C(C1)CN(C(=O)C2CC2=O)NC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H34N4O5/c1-27(2,3)36-29-14-15-30(26(34)35-19-20-10-6-4-7-11-20)22(17-29)18-31(25(33)23-16-24(23)32)28-21-12-8-5-9-13-21/h4-13,22-23,28H,14-19H2,1-3H3