(2R)-2-[[2-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: (2R)-2-[[2-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: (2R)-2-[[2-(3-hydroxy-3-methyl-but-1-ynyl)benzoyl]amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[[2-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (2R)-2-[[2-(3-hydroxy-3-methylbut-1-ynyl)benzoyl]amino]-3-phenylpropanoate Traditional Name: (2R)-2-[[2-(3-hydroxy-3-methyl-but-1-ynyl)benzoyl]amino]-3-phenyl-propionate Formula: C21H20NO4- MolecularWeight: 350.3878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=CC=C1C(=O)NC(CC2=CC=CC=C2)C(=O)[O-])O

Isomeric SMILES

CC(C)(C#CC1=CC=CC=C1C(=O)N[C@H](CC2=CC=CC=C2)C(=O)[O-])O

InChI

InChI=1S/C21H21NO4/c1-21(2,26)13-12-16-10-6-7-11-17(16)19(23)22-18(20(24)25)14-15-8-4-3-5-9-15/h3-11,18,26H,14H2,1-2H3,(H,22,23)(H,24,25)/p-1/t18-/m1/s1