(2S)-4-(4-methoxyphenyl)-2-[[(2R)-1-oxidanylbutan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (2S)-4-(4-methoxyphenyl)-2-[[(2R)-1-oxidanylbutan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (2S)-2-[[(1R)-1-(hydroxymethyl)propyl]amino]-4-(4-methoxyphenyl)-4-oxo-butanoic acid CAS Name: (2S)-2-[[(2R)-1-hydroxybutan-2-yl]amino]-4-(4-methoxyphenyl)-4-oxobutanoic acid IUPAC Name: (2S)-2-[[(2R)-1-hydroxybutan-2-yl]amino]-4-(4-methoxyphenyl)-4-oxobutanoic acid Traditional Name: (2S)-4-keto-4-(4-methoxyphenyl)-2-[[(1R)-1-methylolpropyl]amino]butyric acid Formula: C15H21NO5 MolecularWeight: 295.33094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(CC(=O)C1=CC=C(C=C1)OC)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO5/c1-3-11(9-17)16-13(15(19)20)8-14(18)10-4-6-12(21-2)7-5-10/h4-7,11,13,16-17H,3,8-9H2,1-2H3,(H,19,20)/t11-,13+/m1/s1