N-[4-[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]-2-chloranyl-phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[4-[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]-2-chloranyl-phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-chloro-4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-chloro-4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-chloro-4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-chloro-4-(1,1-diketo-1,2-thiazolidin-2-yl)phenyl]-4-methyl-3-nitro-benzamide Formula: C17H16ClN3O5S MolecularWeight: 409.84404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)N3CCCS3(=O)=O)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)N3CCCS3(=O)=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O5S/c1-11-3-4-12(9-16(11)21(23)24)17(22)19-15-6-5-13(10-14(15)18)20-7-2-8-27(20,25)26/h3-6,9-10H,2,7-8H2,1H3,(H,19,22)