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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-(3-chloranyl-2-methyl-phenyl)-4-nitro-benzamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-N-(1,1-dioxothiolan-3-yl)-4-nitro-benzamide CAS Name: N-(3-chloro-2-methylphenyl)-N-(1,1-dioxo-3-thiolanyl)-4-nitrobenzamide IUPAC Name: N-(3-chloro-2-methylphenyl)-N-(1,1-dioxothiolan-3-yl)-4-nitrobenzamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-N-(1,1-diketothiolan-3-yl)-4-nitro-benzamide Formula: C18H17ClN2O5S MolecularWeight: 408.85598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N(C2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)N(C2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN2O5S/c1-12-16(19)3-2-4-17(12)20(15-9-10-27(25,26)11-15)18(22)13-5-7-14(8-6-13)21(23)24/h2-8,15H,9-11H2,1H3