(4-nitrophenyl)methyl N-[2-(pyrrolidin-1-ylmethylsulfanyl)ethyl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[2-(pyrrolidin-1-ylmethylsulfanyl)ethyl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[2-(pyrrolidin-1-ylmethylsulfanyl)ethyl]carbamate CAS Name: N-[2-(1-pyrrolidinylmethylthio)ethyl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[2-(pyrrolidin-1-ylmethylsulfanyl)ethyl]carbamate Traditional Name: N-[2-(pyrrolidinomethylthio)ethyl]carbamic acid (4-nitrobenzyl) ester Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CSCCNC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CSCCNC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O4S/c19-15(16-7-10-23-12-17-8-1-2-9-17)22-11-13-3-5-14(6-4-13)18(20)21/h3-6H,1-2,7-12H2,(H,16,19)