tert-butyl (3R)-3-[[(2S)-1-acetamido-3-(4-methoxyphenyl)propan-2-yl]carbamoyl]-5-methyl-hexanoate

Systemtic Name: tert-butyl (3R)-3-[[(2S)-1-acetamido-3-(4-methoxyphenyl)propan-2-yl]carbamoyl]-5-methyl-hexanoate Openeye Name: tert-butyl (3R)-3-[[(1S)-1-(acetamidomethyl)-2-(4-methoxyphenyl)ethyl]carbamoyl]-5-methyl-hexanoate CAS Name: (3R)-3-[[[(2S)-1-acetamido-3-(4-methoxyphenyl)propan-2-yl]amino]-oxomethyl]-5-methylhexanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[[(2S)-1-acetamido-3-(4-methoxyphenyl)propan-2-yl]carbamoyl]-5-methylhexanoate Traditional Name: (3R)-3-[[(1S)-1-(acetamidomethyl)-2-(4-methoxyphenyl)ethyl]carbamoyl]-5-methyl-hexanoic acid tert-butyl ester Formula: C24H38N2O5 MolecularWeight: 434.56892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H38N2O5/c1-16(2)12-19(14-22(28)31-24(4,5)6)23(29)26-20(15-25-17(3)27)13-18-8-10-21(30-7)11-9-18/h8-11,16,19-20H,12-15H2,1-7H3,(H,25,27)(H,26,29)/t19-,20+/m1/s1