[azanyl-[4-(phenylcarbonyloxy)butylsulfanyl]methylidene]azanium

Systemtic Name: [azanyl-[4-(phenylcarbonyloxy)butylsulfanyl]methylidene]azanium Openeye Name: [amino(4-benzoyloxybutylsulfanyl)methylene]ammonium CAS Name: [amino-(4-benzoyloxybutylthio)methylidene]ammonium IUPAC Name: [amino(4-benzoyloxybutylsulfanyl)methylidene]azanium Traditional Name: [amino-(4-benzoyloxybutylthio)methylene]ammonium Formula: C12H17N2O2S+ MolecularWeight: 253.34058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCCCSC(=[NH2+])N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCCCSC(=[NH2+])N

InChI

InChI=1S/C12H16N2O2S/c13-12(14)17-9-5-4-8-16-11(15)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H3,13,14)/p+1