furan-2-ylmethyl-[(3S,4R)-4-(2-methoxy-5-methyl-phenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-yl]azanium

Systemtic Name: furan-2-ylmethyl-[(3S,4R)-4-(2-methoxy-5-methyl-phenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-yl]azanium Openeye Name: 2-furylmethyl-[(3S,4R)-4-(2-methoxy-5-methyl-phenyl)sulfonyl-1,1-dioxo-thiolan-3-yl]ammonium CAS Name: 2-furanylmethyl-[(3S,4R)-4-(2-methoxy-5-methylphenyl)sulfonyl-1,1-dioxo-3-thiolanyl]ammonium IUPAC Name: furan-2-ylmethyl-[(3S,4R)-4-(2-methoxy-5-methylphenyl)sulfonyl-1,1-dioxothiolan-3-yl]azanium Traditional Name: [(3S,4R)-1,1-diketo-4-(2-methoxy-5-methyl-phenyl)sulfonyl-thiolan-3-yl]-(2-furfuryl)ammonium Formula: C17H22NO6S2+ MolecularWeight: 400.48968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)C2CS(=O)(=O)CC2[NH2+]CC3=CC=CO3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2[NH2+]CC3=CC=CO3

InChI

InChI=1S/C17H21NO6S2/c1-12-5-6-15(23-2)16(8-12)26(21,22)17-11-25(19,20)10-14(17)18-9-13-4-3-7-24-13/h3-8,14,17-18H,9-11H2,1-2H3/p+1/t14-,17-/m0/s1