(4-nitrophenyl)methyl N-(1-phenyl-3-sulfanyl-propan-2-yl)carbamate

Systemtic Name: (4-nitrophenyl)methyl N-(1-phenyl-3-sulfanyl-propan-2-yl)carbamate Openeye Name: (4-nitrophenyl)methyl N-(1-benzyl-2-sulfanyl-ethyl)carbamate CAS Name: N-(1-mercapto-3-phenylpropan-2-yl)carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-(1-phenyl-3-sulfanylpropan-2-yl)carbamate Traditional Name: N-(1-benzyl-2-mercapto-ethyl)carbamic acid (4-nitrobenzyl) ester Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CS)NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(CS)NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4S/c20-17(18-15(12-24)10-13-4-2-1-3-5-13)23-11-14-6-8-16(9-7-14)19(21)22/h1-9,15,24H,10-12H2,(H,18,20)