(3R,4R)-2-oxidanylidene-4-phenyl-3-(phenylsulfonyl)azetidine-1-sulfonate; tetrabutylazanium

Systemtic Name: (3R,4R)-2-oxidanylidene-4-phenyl-3-(phenylsulfonyl)azetidine-1-sulfonate; tetrabutylazanium Openeye Name: (3R,4R)-3-(benzenesulfonyl)-2-oxo-4-phenyl-azetidine-1-sulfonate; tetrabutylammonium CAS Name: (3R,4R)-3-(benzenesulfonyl)-2-oxo-4-phenyl-1-azetidinesulfonate; tetrabutylammonium IUPAC Name: (3R,4R)-3-(benzenesulfonyl)-2-oxo-4-phenylazetidine-1-sulfonate; tetrabutylazanium Traditional Name: (3R,4R)-3-besyl-2-keto-4-phenyl-azetidine-1-sulfonate; tetrabutylammonium Formula: C31H48N2O6S2 MolecularWeight: 608.85262

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)C2C(C(=O)N2S(=O)(=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)[C@@H]2[C@H](C(=O)N2S(=O)(=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H36N.C15H13NO6S2/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;17-15-14(23(18,19)12-9-5-2-6-10-12)13(16(15)24(20,21)22)11-7-3-1-4-8-11/h5-16H2,1-4H3;1-10,13-14H,(H,20,21,22)/q+1;/p-1/t;13-,14-/m.1/s1