methyl 5-[4-[2-(4-chloranylnaphthalen-1-yl)oxyethanoyl]piperazin-1-yl]sulfonylthiophene-3-carboxylate

Systemtic Name: methyl 5-[4-[2-(4-chloranylnaphthalen-1-yl)oxyethanoyl]piperazin-1-yl]sulfonylthiophene-3-carboxylate Openeye Name: methyl 5-[4-[2-[(4-chloro-1-naphthyl)oxy]acetyl]piperazin-1-yl]sulfonylthiophene-3-carboxylate CAS Name: 5-[[4-[2-[(4-chloro-1-naphthalenyl)oxy]-1-oxoethyl]-1-piperazinyl]sulfonyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[4-[2-(4-chloronaphthalen-1-yl)oxyacetyl]piperazin-1-yl]sulfonylthiophene-3-carboxylate Traditional Name: 5-[4-[2-(4-chloro-1-naphthoxy)acetyl]piperazino]sulfonylthiophene-3-carboxylic acid methyl ester Formula: C22H21ClN2O6S2 MolecularWeight: 508.99494

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=C(C4=CC=CC=C43)Cl

Isomeric SMILES

COC(=O)C1=CSC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=C(C4=CC=CC=C43)Cl

InChI

InChI=1S/C22H21ClN2O6S2/c1-30-22(27)15-12-21(32-14-15)33(28,29)25-10-8-24(9-11-25)20(26)13-31-19-7-6-18(23)16-4-2-3-5-17(16)19/h2-7,12,14H,8-11,13H2,1H3