1-[2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]hydrazinyl]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylate

Systemtic Name: 1-[2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]hydrazinyl]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylate Openeye Name: 1-[2-[2-(3-chlorobenzothiophene-2-carbonyl)hydrazino]-2-oxo-ethyl]cyclohexanecarboxylate CAS Name: 1-[2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-2-oxoethyl]-1-cyclohexanecarboxylate IUPAC Name: 1-[2-[2-(3-chloro-1-benzothiophene-2-carbonyl)hydrazinyl]-2-oxoethyl]cyclohexane-1-carboxylate Traditional Name: 1-[2-[N'-(3-chlorobenzothiophene-2-carbonyl)hydrazino]-2-keto-ethyl]cyclohexanecarboxylate Formula: C18H18ClN2O4S- MolecularWeight: 393.86452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)(CC(=O)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)[O-]

InChI

InChI=1S/C18H19ClN2O4S/c19-14-11-6-2-3-7-12(11)26-15(14)16(23)21-20-13(22)10-18(17(24)25)8-4-1-5-9-18/h2-3,6-7H,1,4-5,8-10H2,(H,20,22)(H,21,23)(H,24,25)/p-1