(4S)-3-[(3S)-3-(2-nitrophenyl)-3-sulfanyl-propanoyl]-4-propan-2-yl-1,3-oxazolidin-2-one

Systemtic Name: (4S)-3-[(3S)-3-(2-nitrophenyl)-3-sulfanyl-propanoyl]-4-propan-2-yl-1,3-oxazolidin-2-one Openeye Name: (4S)-4-isopropyl-3-[(3S)-3-(2-nitrophenyl)-3-sulfanyl-propanoyl]oxazolidin-2-one CAS Name: (4S)-3-[(3S)-3-mercapto-3-(2-nitrophenyl)-1-oxopropyl]-4-propan-2-yl-2-oxazolidinone IUPAC Name: (4S)-3-[(3S)-3-(2-nitrophenyl)-3-sulfanylpropanoyl]-4-propan-2-yl-1,3-oxazolidin-2-one Traditional Name: (4S)-4-isopropyl-3-[(3S)-3-mercapto-3-(2-nitrophenyl)propanoyl]oxazolidin-2-one Formula: C15H18N2O5S MolecularWeight: 338.37882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1COC(=O)N1C(=O)CC(C2=CC=CC=C2[N+](=O)[O-])S

Isomeric SMILES

CC(C)[C@H]1COC(=O)N1C(=O)C[C@@H](C2=CC=CC=C2[N+](=O)[O-])S

InChI

InChI=1S/C15H18N2O5S/c1-9(2)12-8-22-15(19)16(12)14(18)7-13(23)10-5-3-4-6-11(10)17(20)21/h3-6,9,12-13,23H,7-8H2,1-2H3/t12-,13+/m1/s1