[2-[(2S)-2-azanyl-3-methyl-butanoyl]oxy-4-(3-methoxy-3-oxidanylidene-propyl)phenyl] (2S)-2-azanyl-3-methyl-butanoate

Systemtic Name: [2-[(2S)-2-azanyl-3-methyl-butanoyl]oxy-4-(3-methoxy-3-oxidanylidene-propyl)phenyl] (2S)-2-azanyl-3-methyl-butanoate Openeye Name: [2-[(2S)-2-amino-3-methyl-butanoyl]oxy-4-(3-methoxy-3-oxo-propyl)phenyl] (2S)-2-amino-3-methyl-butanoate CAS Name: (2S)-2-amino-3-methylbutanoic acid [2-[(2S)-2-amino-3-methyl-1-oxobutoxy]-4-(3-methoxy-3-oxopropyl)phenyl] ester IUPAC Name: [2-[(2S)-2-amino-3-methylbutanoyl]oxy-4-(3-methoxy-3-oxopropyl)phenyl] (2S)-2-amino-3-methylbutanoate Traditional Name: (2S)-2-amino-3-methyl-butyric acid [2-[(2S)-2-amino-3-methyl-butanoyl]oxy-4-(3-keto-3-methoxy-propyl)phenyl] ester Formula: C20H30N2O6 MolecularWeight: 394.462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1=C(C=C(C=C1)CCC(=O)OC)OC(=O)C(C(C)C)N)N

Isomeric SMILES

CC(C)[C@@H](C(=O)OC1=C(C=C(C=C1)CCC(=O)OC)OC(=O)[C@H](C(C)C)N)N

InChI

InChI=1S/C20H30N2O6/c1-11(2)17(21)19(24)27-14-8-6-13(7-9-16(23)26-5)10-15(14)28-20(25)18(22)12(3)4/h6,8,10-12,17-18H,7,9,21-22H2,1-5H3/t17-,18-/m0/s1