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2-azaniumylsulfonylbenzoate; piperidin-1-ide

2-azaniumylsulfonylbenzoate; piperidin-1-ide

Systemtic Name:2-azaniumylsulfonylbenzoate; piperidin-1-ide
Openeye Name:2-azaniumylsulfonylbenzoate; piperidin-1-ide
CAS Name:2-ammoniosulfonylbenzoate; piperidin-1-ide
IUPAC Name:2-azaniumylsulfonylbenzoate; piperidin-1-ide
Traditional Name:2-ammoniosulfonylbenzoate; piperidin-1-ide
Formula: C12H17N2O4S-
MolecularWeight: 285.33938
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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N-]CC1.C1=CC=C(C(=C1)C(=O)[O-])S(=O)(=O)[NH3+]


Isomeric SMILES

C1CC[N-]CC1.C1=CC=C(C(=C1)C(=O)[O-])S(=O)(=O)[NH3+]


InChI

InChI=1S/C7H7NO4S.C5H10N/c8-13(11,12)6-4-2-1-3-5(6)7(9)10;1-2-4-6-5-3-1/h1-4H,(H,9,10)(H2,8,11,12);1-5H2/q;-1


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