tert-butyl N-[(2S,3S)-1-[[(1R)-1-isocyanato-2-methyl-propyl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3S)-1-[[(1R)-1-isocyanato-2-methyl-propyl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2S)-1-[[(1R)-1-isocyanato-2-methyl-propyl]carbamoyl]-2-methyl-butyl]carbamate CAS Name: N-[(2S,3S)-1-[[(1R)-1-isocyanato-2-methylpropyl]amino]-3-methyl-1-oxopentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3S)-1-[[(1R)-1-isocyanato-2-methylpropyl]amino]-3-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S,2S)-1-[[(1R)-1-isocyanato-2-methyl-propyl]carbamoyl]-2-methyl-butyl]carbamic acid tert-butyl ester Formula: C16H29N3O4 MolecularWeight: 327.41916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)C)N=C=O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)N=C=O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H29N3O4/c1-8-11(4)12(18-15(22)23-16(5,6)7)14(21)19-13(10(2)3)17-9-20/h10-13H,8H2,1-7H3,(H,18,22)(H,19,21)/t11-,12-,13-/m0/s1