diethylazanium; phenylazanyl(pyridin-4-yl)methanesulfonate

Systemtic Name: diethylazanium; phenylazanyl(pyridin-4-yl)methanesulfonate Openeye Name: anilino(4-pyridyl)methanesulfonate; diethylammonium CAS Name: anilino(pyridin-4-yl)methanesulfonate; diethylammonium IUPAC Name: anilino(pyridin-4-yl)methanesulfonate; diethylazanium Traditional Name: anilino(4-pyridyl)methanesulfonate; diethylammonium Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC.C1=CC=C(C=C1)NC(C2=CC=NC=C2)S(=O)(=O)[O-]

Isomeric SMILES

CC[NH2+]CC.C1=CC=C(C=C1)NC(C2=CC=NC=C2)S(=O)(=O)[O-]

InChI

InChI=1S/C12H12N2O3S.C4H11N/c15-18(16,17)12(10-6-8-13-9-7-10)14-11-4-2-1-3-5-11;1-3-5-4-2/h1-9,12,14H,(H,15,16,17);5H,3-4H2,1-2H3