[(2-cyclopentylphenyl)-methoxycarbonylsulfanyl-methyl-azaniumyl]methanoate

Systemtic Name: [(2-cyclopentylphenyl)-methoxycarbonylsulfanyl-methyl-azaniumyl]methanoate Openeye Name: [(2-cyclopentylphenyl)-methoxycarbonylsulfanyl-methyl-ammonio]formate CAS Name: [(2-cyclopentylphenyl)-(methoxycarbonylthio)-methylammonio]formate IUPAC Name: [(2-cyclopentylphenyl)-methoxycarbonylsulfanyl-methylazaniumyl]formate Traditional Name: [(carbomethoxythio)-(2-cyclopentylphenyl)-methyl-ammonio]formate Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C1=CC=CC=C1C2CCCC2)(C(=O)[O-])SC(=O)OC

Isomeric SMILES

C[N+](C1=CC=CC=C1C2CCCC2)(C(=O)[O-])SC(=O)OC

InChI

InChI=1S/C15H19NO4S/c1-16(14(17)18,21-15(19)20-2)13-10-6-5-9-12(13)11-7-3-4-8-11/h5-6,9-11H,3-4,7-8H2,1-2H3