[tert-butyl-[1-(6-methoxynaphthalen-2-yl)ethyl]-oxidanyl-azaniumyl]methanethioate

Systemtic Name: [tert-butyl-[1-(6-methoxynaphthalen-2-yl)ethyl]-oxidanyl-azaniumyl]methanethioate Openeye Name: [tert-butyl-hydroxy-[1-(6-methoxy-2-naphthyl)ethyl]ammonio]methanethioate CAS Name: [tert-butyl-hydroxy-[1-(6-methoxy-2-naphthalenyl)ethyl]ammonio]methanethioate IUPAC Name: [tert-butyl-hydroxy-[1-(6-methoxynaphthalen-2-yl)ethyl]azaniumyl]methanethioate Traditional Name: [tert-butyl-hydroxy-[1-(6-methoxy-2-naphthyl)ethyl]ammonio]thioformate Formula: C18H23NO3S MolecularWeight: 333.44512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)[N+](C(=S)[O-])(C(C)(C)C)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)[N+](C(=S)[O-])(C(C)(C)C)O

InChI

InChI=1S/C18H23NO3S/c1-12(19(21,17(20)23)18(2,3)4)13-6-7-15-11-16(22-5)9-8-14(15)10-13/h6-12,21H,1-5H3