5-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]hydrazinyl]-3,3-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: 5-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]hydrazinyl]-3,3-dimethyl-5-oxidanylidene-pentanoate Openeye Name: 5-[2-(3-chlorobenzothiophene-2-carbonyl)hydrazino]-3,3-dimethyl-5-oxo-pentanoate CAS Name: 5-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-3,3-dimethyl-5-oxopentanoate IUPAC Name: 5-[2-(3-chloro-1-benzothiophene-2-carbonyl)hydrazinyl]-3,3-dimethyl-5-oxopentanoate Traditional Name: 5-[N'-(3-chlorobenzothiophene-2-carbonyl)hydrazino]-5-keto-3,3-dimethyl-valerate Formula: C16H16ClN2O4S- MolecularWeight: 367.82724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NNC(=O)C1=C(C2=CC=CC=C2S1)Cl)CC(=O)[O-]

Isomeric SMILES

CC(C)(CC(=O)NNC(=O)C1=C(C2=CC=CC=C2S1)Cl)CC(=O)[O-]

InChI

InChI=1S/C16H17ClN2O4S/c1-16(2,8-12(21)22)7-11(20)18-19-15(23)14-13(17)9-5-3-4-6-10(9)24-14/h3-6H,7-8H2,1-2H3,(H,18,20)(H,19,23)(H,21,22)/p-1