(2S,3S)-2-[2-(4-hydroxyphenyl)ethanoylamino]-3-methyl-pentanoate

Systemtic Name: (2S,3S)-2-[2-(4-hydroxyphenyl)ethanoylamino]-3-methyl-pentanoate Openeye Name: (2S,3S)-2-[[2-(4-hydroxyphenyl)acetyl]amino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[2-(4-hydroxyphenyl)-1-oxoethyl]amino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-[[2-(4-hydroxyphenyl)acetyl]amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[[2-(4-hydroxyphenyl)acetyl]amino]-3-methyl-valerate Formula: C14H18NO4- MolecularWeight: 264.29702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)CC1=CC=C(C=C1)O

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO4/c1-3-9(2)13(14(18)19)15-12(17)8-10-4-6-11(16)7-5-10/h4-7,9,13,16H,3,8H2,1-2H3,(H,15,17)(H,18,19)/p-1/t9-,13-/m0/s1