tert-butyl N-[6-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-6-oxidanylidene-hexyl]carbamate

Systemtic Name: tert-butyl N-[6-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-6-oxidanylidene-hexyl]carbamate Openeye Name: tert-butyl N-[6-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]amino]-6-oxo-hexyl]carbamate CAS Name: N-[6-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-6-oxohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[6-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-6-oxohexyl]carbamate Traditional Name: N-[6-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]amino]-6-keto-hexyl]carbamic acid tert-butyl ester Formula: C20H31N3O4 MolecularWeight: 377.47784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N

InChI

InChI=1S/C20H31N3O4/c1-20(2,3)27-19(26)22-13-9-5-8-12-17(24)23-16(18(21)25)14-15-10-6-4-7-11-15/h4,6-7,10-11,16H,5,8-9,12-14H2,1-3H3,(H2,21,25)(H,22,26)(H,23,24)/t16-/m0/s1