N'-(2-chloranyl-5-nitro-phenyl)carbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide

Systemtic Name: N'-(2-chloranyl-5-nitro-phenyl)carbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide Openeye Name: N'-(2-chloro-5-nitro-benzoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide CAS Name: N'-[(2-chloro-5-nitrophenyl)-oxomethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide IUPAC Name: N'-(2-chloro-5-nitrobenzoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide Traditional Name: N'-(2-chloro-5-nitro-benzoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide Formula: C17H16ClN3O4S MolecularWeight: 393.84464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)NNC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)NNC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H16ClN3O4S/c18-13-7-6-11(21(24)25)9-12(13)16(22)19-20-17(23)15-8-10-4-2-1-3-5-14(10)26-15/h6-9H,1-5H2,(H,19,22)(H,20,23)