tert-butyl (3R)-3-[[(2S)-3-methyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]-6-phenyl-hexanoate

Systemtic Name: tert-butyl (3R)-3-[[(2S)-3-methyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]-6-phenyl-hexanoate Openeye Name: tert-butyl (3R)-3-[[(1S)-2-methyl-1-(methylcarbamoyl)propyl]carbamoyl]-6-phenyl-hexanoate CAS Name: (3R)-3-[[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]amino]-oxomethyl]-6-phenylhexanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]-6-phenylhexanoate Traditional Name: (3R)-3-[[(1S)-2-methyl-1-(methylcarbamoyl)propyl]carbamoyl]-6-phenyl-hexanoic acid tert-butyl ester Formula: C23H36N2O4 MolecularWeight: 404.54294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC)NC(=O)C(CCCC1=CC=CC=C1)CC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)NC)NC(=O)[C@H](CCCC1=CC=CC=C1)CC(=O)OC(C)(C)C

InChI

InChI=1S/C23H36N2O4/c1-16(2)20(22(28)24-6)25-21(27)18(15-19(26)29-23(3,4)5)14-10-13-17-11-8-7-9-12-17/h7-9,11-12,16,18,20H,10,13-15H2,1-6H3,(H,24,28)(H,25,27)/t18-,20+/m1/s1