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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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