2-azanyl-4-methylsulfonyl-butan-1-ol; bicyclo[4.1.0]hepta-1,3,5-triene

Systemtic Name: 2-azanyl-4-methylsulfonyl-butan-1-ol; bicyclo[4.1.0]hepta-1,3,5-triene Openeye Name: 2-amino-4-methylsulfonyl-butan-1-ol; bicyclo[4.1.0]hepta-1,3,5-triene CAS Name: 2-amino-4-methylsulfonyl-1-butanol; bicyclo[4.1.0]hepta-1,3,5-triene IUPAC Name: 2-amino-4-methylsulfonylbutan-1-ol; bicyclo[4.1.0]hepta-1,3,5-triene Traditional Name: 2-amino-4-mesyl-butan-1-ol; bicyclo[4.1.0]hepta-1,3,5-triene Formula: C12H19NO3S MolecularWeight: 257.34916

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(CO)N.C1C2=CC=CC=C21

Isomeric SMILES

CS(=O)(=O)CCC(CO)N.C1C2=CC=CC=C21

InChI

InChI=1S/C7H6.C5H13NO3S/c1-2-4-7-5-6(7)3-1;1-10(8,9)3-2-5(6)4-7/h1-4H,5H2;5,7H,2-4,6H2,1H3