methyl (2R)-4-[3-[(4-nitrophenyl)carbonylamino]propanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[3-[(4-nitrophenyl)carbonylamino]propanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[3-[(4-nitrobenzoyl)amino]propanoyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[3-[[(4-nitrophenyl)-oxomethyl]amino]-1-oxopropyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[3-[(4-nitrobenzoyl)amino]propanoyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[3-[(4-nitrobenzoyl)amino]propanoyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C16H19N3O6S MolecularWeight: 381.40356

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)C(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@H]1CN(CCS1)C(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O6S/c1-25-16(22)13-10-18(8-9-26-13)14(20)6-7-17-15(21)11-2-4-12(5-3-11)19(23)24/h2-5,13H,6-10H2,1H3,(H,17,21)/t13-/m1/s1