(2S,3S)-2-[(3-methoxy-2-oxidanyl-phenyl)carbonylamino]-3-methyl-pentanoate

Systemtic Name: (2S,3S)-2-[(3-methoxy-2-oxidanyl-phenyl)carbonylamino]-3-methyl-pentanoate Openeye Name: (2S,3S)-2-[(2-hydroxy-3-methoxy-benzoyl)amino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[(2-hydroxy-3-methoxyphenyl)-oxomethyl]amino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-[(2-hydroxy-3-methoxybenzoyl)amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[(2-hydroxy-3-methoxy-benzoyl)amino]-3-methyl-valerate Formula: C14H18NO5- MolecularWeight: 280.29642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO5/c1-4-8(2)11(14(18)19)15-13(17)9-6-5-7-10(20-3)12(9)16/h5-8,11,16H,4H2,1-3H3,(H,15,17)(H,18,19)/p-1/t8-,11-/m0/s1