tert-butyl N-[(2S)-1-(but-3-enylamino)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-(but-3-enylamino)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(4-benzyloxyphenyl)methyl]-2-(but-3-enylamino)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-(but-3-enylamino)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(but-3-enylamino)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]carbamate Traditional Name: N-[(1S)-1-(4-benzoxybenzyl)-2-(but-3-enylamino)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NCCC=C

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NCCC=C

InChI

InChI=1S/C25H32N2O4/c1-5-6-16-26-23(28)22(27-24(29)31-25(2,3)4)17-19-12-14-21(15-13-19)30-18-20-10-8-7-9-11-20/h5,7-15,22H,1,6,16-18H2,2-4H3,(H,26,28)(H,27,29)/t22-/m0/s1