2-methyl-4-oxidanyl-5-propan-2-yl-benzenesulfonic acid; 2-[(Z)-pentylideneamino]guanidine

Systemtic Name: 2-methyl-4-oxidanyl-5-propan-2-yl-benzenesulfonic acid; 2-[(Z)-pentylideneamino]guanidine Openeye Name: 4-hydroxy-5-isopropyl-2-methyl-benzenesulfonic acid; 2-[(Z)-pentylideneamino]guanidine CAS Name: 4-hydroxy-2-methyl-5-propan-2-ylbenzenesulfonic acid; 2-[(Z)-pentylideneamino]guanidine IUPAC Name: 4-hydroxy-2-methyl-5-propan-2-ylbenzenesulfonic acid; 2-[(Z)-pentylideneamino]guanidine Traditional Name: 4-hydroxy-5-isopropyl-2-methyl-besylic acid; 2-[(Z)-pentylideneamino]guanidine Formula: C16H28N4O4S MolecularWeight: 372.48292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=NN=C(N)N.CC1=CC(=C(C=C1S(=O)(=O)O)C(C)C)O

Isomeric SMILES

CCCC/C=N\N=C(N)N.CC1=CC(=C(C=C1S(=O)(=O)O)C(C)C)O

InChI

InChI=1S/C10H14O4S.C6H14N4/c1-6(2)8-5-10(15(12,13)14)7(3)4-9(8)11;1-2-3-4-5-9-10-6(7)8/h4-6,11H,1-3H3,(H,12,13,14);5H,2-4H2,1H3,(H4,7,8,10)/b;9-5-