(E,3S)-2-diazonio-3-(furan-2-yl)-3-[(4-methylphenyl)sulfonylamino]-1-[(4S)-2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]prop-1-en-1-olate

Systemtic Name: (E,3S)-2-diazonio-3-(furan-2-yl)-3-[(4-methylphenyl)sulfonylamino]-1-[(4S)-2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]prop-1-en-1-olate Openeye Name: (E,3S)-1-[(4S)-4-benzyl-2-oxo-oxazolidin-3-yl]-2-diazonio-3-(2-furyl)-3-(p-tolylsulfonylamino)prop-1-en-1-olate CAS Name: (E,3S)-2-diazonio-3-(2-furanyl)-3-[(4-methylphenyl)sulfonylamino]-1-[(4S)-2-oxo-4-(phenylmethyl)-3-oxazolidinyl]-1-propen-1-olate IUPAC Name: (E,3S)-1-[(4S)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-diazonio-3-(furan-2-yl)-3-[(4-methylphenyl)sulfonylamino]prop-1-en-1-olate Traditional Name: (E,3S)-1-[(4S)-4-benzyl-2-keto-oxazolidin-3-yl]-2-diazonio-3-(2-furyl)-3-(tosylamino)prop-1-en-1-olate Formula: C24H22N4O6S MolecularWeight: 494.51968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CO2)C(=C(N3C(COC3=O)CC4=CC=CC=C4)[O-])[N+]#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C2=CC=CO2)/C(=C(/N3[C@H](COC3=O)CC4=CC=CC=C4)\[O-])/[N+]#N

InChI

InChI=1S/C24H22N4O6S/c1-16-9-11-19(12-10-16)35(31,32)27-21(20-8-5-13-33-20)22(26-25)23(29)28-18(15-34-24(28)30)14-17-6-3-2-4-7-17/h2-13,18,21,27H,14-15H2,1H3/b23-22+/t18-,21+/m0/s1