2-(3-hydroxyphenyl)-2-[[(2S)-1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoylamino]ethanoic acid

Systemtic Name: 2-(3-hydroxyphenyl)-2-[[(2S)-1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoylamino]ethanoic acid Openeye Name: 2-(3-hydroxyphenyl)-2-[[(1S)-1-methoxycarbonyl-3-methyl-butyl]carbamoylamino]acetic acid CAS Name: 2-(3-hydroxyphenyl)-2-[[[[(2S)-1-methoxy-4-methyl-1-oxopentan-2-yl]amino]-oxomethyl]amino]acetic acid IUPAC Name: 2-(3-hydroxyphenyl)-2-[[(2S)-1-methoxy-4-methyl-1-oxopentan-2-yl]carbamoylamino]acetic acid Traditional Name: 2-[[(1S)-1-carbomethoxy-3-methyl-butyl]carbamoylamino]-2-(3-hydroxyphenyl)acetic acid Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O6/c1-9(2)7-12(15(22)24-3)17-16(23)18-13(14(20)21)10-5-4-6-11(19)8-10/h4-6,8-9,12-13,19H,7H2,1-3H3,(H,20,21)(H2,17,18,23)/t12-,13?/m0/s1