tert-butyl (3R)-5-methyl-3-[[(2S)-1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-2-methylidene-hexanoate

Systemtic Name: tert-butyl (3R)-5-methyl-3-[[(2S)-1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-2-methylidene-hexanoate Openeye Name: tert-butyl (3R)-3-[[(1S)-1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]-5-methyl-2-methylene-hexanoate CAS Name: (3R)-5-methyl-3-[[[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-methylenehexanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-5-methyl-3-[[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]-2-methylidenehexanoate Traditional Name: 2-[(1R)-1-[[(1S)-1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]-3-methyl-butyl]acrylic acid tert-butyl ester Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N2O4/c1-15(2)13-18(16(3)22(28)29-23(4,5)6)20(26)25-19(21(27)24-7)14-17-11-9-8-10-12-17/h8-12,15,18-19H,3,13-14H2,1-2,4-7H3,(H,24,27)(H,25,26)/t18-,19+/m1/s1