3-[(4-chlorophenyl)methyl]-5-(2-nitrophenyl)-1,1-bis(oxidanylidene)-2,3-dihydro-1,2-thiazol-4-ol

Systemtic Name: 3-[(4-chlorophenyl)methyl]-5-(2-nitrophenyl)-1,1-bis(oxidanylidene)-2,3-dihydro-1,2-thiazol-4-ol Openeye Name: 3-[(4-chlorophenyl)methyl]-5-(2-nitrophenyl)-1,1-dioxo-2,3-dihydroisothiazol-4-ol CAS Name: 3-[(4-chlorophenyl)methyl]-5-(2-nitrophenyl)-1,1-dioxo-2,3-dihydroisothiazol-4-ol IUPAC Name: 3-[(4-chlorophenyl)methyl]-5-(2-nitrophenyl)-1,1-dioxo-2,3-dihydro-1,2-thiazol-4-ol Traditional Name: 3-(4-chlorobenzyl)-1,1-diketo-5-(2-nitrophenyl)-2,3-dihydroisothiazol-4-ol Formula: C16H13ClN2O5S MolecularWeight: 380.80282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C(NS2(=O)=O)CC3=CC=C(C=C3)Cl)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C(NS2(=O)=O)CC3=CC=C(C=C3)Cl)O)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN2O5S/c17-11-7-5-10(6-8-11)9-13-15(20)16(25(23,24)18-13)12-3-1-2-4-14(12)19(21)22/h1-8,13,18,20H,9H2