(4-nitrophenyl)methyl 3-sulfanylazetidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 3-sulfanylazetidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 3-sulfanylazetidine-1-carboxylate CAS Name: 3-mercapto-1-azetidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-sulfanylazetidine-1-carboxylate Traditional Name: 3-mercaptoazetidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C11H12N2O4S MolecularWeight: 268.28898

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])S

Isomeric SMILES

C1C(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])S

InChI

InChI=1S/C11H12N2O4S/c14-11(12-5-10(18)6-12)17-7-8-1-3-9(4-2-8)13(15)16/h1-4,10,18H,5-7H2