(phenylmethyl) N-[(2S)-1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-1,4-bis(oxidanylidene)-4-[4-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-1,4-bis(oxidanylidene)-4-[4-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]butan-2-yl]carbamate Openeye Name: tert-butyl N-[2-[[(2S)-4-(1-benzyl-4-oxo-3-piperidyl)-2-(benzyloxycarbonylamino)-4-oxo-butanoyl]amino]ethyl]carbamate CAS Name: N-[2-[[(2S)-1,4-dioxo-4-[4-oxo-1-(phenylmethyl)-3-piperidinyl]-2-(phenylmethoxycarbonylamino)butyl]amino]ethyl]carbamic acid tert-butyl ester IUPAC Name: benzyl N-[(2S)-4-(1-benzyl-4-oxopiperidin-3-yl)-1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-1,4-dioxobutan-2-yl]carbamate Traditional Name: N-[2-[[(2S)-4-(1-benzyl-4-keto-3-piperidyl)-2-(benzyloxycarbonylamino)-4-keto-butanoyl]amino]ethyl]carbamic acid tert-butyl ester Formula: C31H40N4O7 MolecularWeight: 580.6719

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNC(=O)C(CC(=O)C1CN(CCC1=O)CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCCNC(=O)[C@H](CC(=O)C1CN(CCC1=O)CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C31H40N4O7/c1-31(2,3)42-29(39)33-16-15-32-28(38)25(34-30(40)41-21-23-12-8-5-9-13-23)18-27(37)24-20-35(17-14-26(24)36)19-22-10-6-4-7-11-22/h4-13,24-25H,14-21H2,1-3H3,(H,32,38)(H,33,39)(H,34,40)/t24?,25-/m0/s1