2,5-bis(azanyl)-5-[2-(ethyl-methyl-sulfinato-azaniumyl)ethyl]-3-methyl-cyclohexa-1,3-diene

Systemtic Name: 2,5-bis(azanyl)-5-[2-(ethyl-methyl-sulfinato-azaniumyl)ethyl]-3-methyl-cyclohexa-1,3-diene Openeye Name: 2,5-diamino-5-[2-(ethyl-methyl-sulfinato-ammonio)ethyl]-3-methyl-cyclohexa-1,3-diene CAS Name: 2,5-diamino-5-[2-(ethyl-methyl-sulfinatoammonio)ethyl]-3-methylcyclohexa-1,3-diene IUPAC Name: 2,5-diamino-5-[2-(ethyl-methyl-sulfinatoazaniumyl)ethyl]-3-methylcyclohexa-1,3-diene Traditional Name: 2,5-diamino-5-[2-(ethyl-methyl-sulfinato-ammonio)ethyl]-3-methyl-cyclohexa-1,3-diene Formula: C12H23N3O2S MolecularWeight: 273.39492

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CCC1(CC=C(C(=C1)C)N)N)S(=O)[O-]

Isomeric SMILES

CC[N+](C)(CCC1(CC=C(C(=C1)C)N)N)S(=O)[O-]

InChI

InChI=1S/C12H23N3O2S/c1-4-15(3,18(16)17)8-7-12(14)6-5-11(13)10(2)9-12/h5,9H,4,6-8,13-14H2,1-3H3