(2R)-2-[[(3S)-3-azanyl-6-azanyloxy-6-oxidanylidene-2-sulfanyl-hexanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: (2R)-2-[[(3S)-3-azanyl-6-azanyloxy-6-oxidanylidene-2-sulfanyl-hexanoyl]amino]-3-phenyl-propanoic acid Openeye Name: (2R)-2-[[(3S)-3-amino-6-aminooxy-6-oxo-2-sulfanyl-hexanoyl]amino]-3-phenyl-propanoic acid CAS Name: (2R)-2-[[(3S)-3-amino-6-aminooxy-2-mercapto-1,6-dioxohexyl]amino]-3-phenylpropanoic acid IUPAC Name: (2R)-2-[[(3S)-3-amino-6-aminooxy-6-oxo-2-sulfanylhexanoyl]amino]-3-phenylpropanoic acid Traditional Name: (2R)-2-[[(3S)-3-amino-6-aminooxy-6-keto-2-mercapto-hexanoyl]amino]-3-phenyl-propionic acid Formula: C15H21N3O5S MolecularWeight: 355.40934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(C(CCC(=O)ON)N)S

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)O)NC(=O)C([C@H](CCC(=O)ON)N)S

InChI

InChI=1S/C15H21N3O5S/c16-10(6-7-12(19)23-17)13(24)14(20)18-11(15(21)22)8-9-4-2-1-3-5-9/h1-5,10-11,13,24H,6-8,16-17H2,(H,18,20)(H,21,22)/t10-,11+,13?/m0/s1