2-[1,4-bis(azanyl)-3-methyl-cyclohexa-2,4-dien-1-yl]ethyl-ethyl-methyl-sulfino-azanium

Systemtic Name: 2-[1,4-bis(azanyl)-3-methyl-cyclohexa-2,4-dien-1-yl]ethyl-ethyl-methyl-sulfino-azanium Openeye Name: 2-(1,4-diamino-3-methyl-cyclohexa-2,4-dien-1-yl)ethyl-ethyl-methyl-sulfino-ammonium CAS Name: 2-(1,4-diamino-3-methyl-1-cyclohexa-2,4-dienyl)ethyl-ethyl-methyl-sulfinoammonium IUPAC Name: 2-(1,4-diamino-3-methylcyclohexa-2,4-dien-1-yl)ethyl-ethyl-methyl-sulfinoazanium Traditional Name: 2-(1,4-diamino-3-methyl-cyclohexa-2,4-dien-1-yl)ethyl-ethyl-methyl-sulfino-ammonium Formula: C12H24N3O2S+ MolecularWeight: 274.40286

Click to see the large picture

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/p+1