tert-butyl (NE)-N-[[4-[2-[1-[(2R)-2-azanyl-3-phenyl-propanoyl]piperidin-2-yl]ethoxy]piperidin-1-yl]-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]carbamate

Systemtic Name: tert-butyl (NE)-N-[[4-[2-[1-[(2R)-2-azanyl-3-phenyl-propanoyl]piperidin-2-yl]ethoxy]piperidin-1-yl]-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]carbamate Openeye Name: tert-butyl (NE)-N-[[4-[2-[1-[(2R)-2-amino-3-phenyl-propanoyl]-2-piperidyl]ethoxy]-1-piperidyl]-(tert-butoxycarbonylamino)methylene]carbamate CAS Name: (NE)-N-[[4-[2-[1-[(2R)-2-amino-1-oxo-3-phenylpropyl]-2-piperidinyl]ethoxy]-1-piperidinyl]-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methylidene]carbamic acid tert-butyl ester IUPAC Name: tert-butyl (NE)-N-[[4-[2-[1-[(2R)-2-amino-3-phenylpropanoyl]piperidin-2-yl]ethoxy]piperidin-1-yl]-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]carbamate Traditional Name: (NE)-N-[[4-[2-[1-[(2R)-2-amino-3-phenyl-propanoyl]-2-piperidyl]ethoxy]piperidino]-(tert-butoxycarbonylamino)methylene]carbamic acid tert-butyl ester Formula: C32H51N5O6 MolecularWeight: 601.77724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=NC(=O)OC(C)(C)C)N1CCC(CC1)OCCC2CCCCN2C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

CC(C)(C)OC(=O)N/C(=N\C(=O)OC(C)(C)C)/N1CCC(CC1)OCCC2CCCCN2C(=O)[C@@H](CC3=CC=CC=C3)N

InChI

InChI=1S/C32H51N5O6/c1-31(2,3)42-29(39)34-28(35-30(40)43-32(4,5)6)36-19-15-25(16-20-36)41-21-17-24-14-10-11-18-37(24)27(38)26(33)22-23-12-8-7-9-13-23/h7-9,12-13,24-26H,10-11,14-22,33H2,1-6H3,(H,34,35,39,40)/t24?,26-/m1/s1