(3R,6R)-5-oxidanylidene-6-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]thiomorpholine-3-carboxylate

Systemtic Name: (3R,6R)-5-oxidanylidene-6-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]thiomorpholine-3-carboxylate Openeye Name: (3R,6R)-6-[2-(benzylamino)-2-oxo-ethyl]-5-oxo-thiomorpholine-3-carboxylate CAS Name: (3R,6R)-5-oxo-6-[2-oxo-2-[(phenylmethyl)amino]ethyl]-3-thiomorpholinecarboxylate IUPAC Name: (3R,6R)-6-[2-(benzylamino)-2-oxoethyl]-5-oxothiomorpholine-3-carboxylate Traditional Name: (3R,6R)-6-[2-(benzylamino)-2-keto-ethyl]-5-keto-thiomorpholine-3-carboxylate Formula: C14H15N2O4S- MolecularWeight: 307.3449

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C(S1)CC(=O)NCC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

C1[C@H](NC(=O)[C@H](S1)CC(=O)NCC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C14H16N2O4S/c17-12(15-7-9-4-2-1-3-5-9)6-11-13(18)16-10(8-21-11)14(19)20/h1-5,10-11H,6-8H2,(H,15,17)(H,16,18)(H,19,20)/p-1/t10-,11+/m0/s1