5-chloranyl-N-(3,4-dihydro-2H-thiochromen-4-yl)-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-(3,4-dihydro-2H-thiochromen-4-yl)-2-nitro-benzamide Openeye Name: 5-chloro-2-nitro-N-thiochroman-4-yl-benzamide CAS Name: 5-chloro-N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-nitrobenzamide IUPAC Name: 5-chloro-N-(3,4-dihydro-2H-thiochromen-4-yl)-2-nitrobenzamide Traditional Name: 5-chloro-2-nitro-N-thiochroman-4-yl-benzamide Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN2O3S/c17-10-5-6-14(19(21)22)12(9-10)16(20)18-13-7-8-23-15-4-2-1-3-11(13)15/h1-6,9,13H,7-8H2,(H,18,20)