methyl 1-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperidine-4-carboxylate Openeye Name: methyl 1-(3-chlorobenzothiophene-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-chloro-1-benzothiophene-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(3-chlorobenzothiophene-2-carbonyl)isonipecotic acid methyl ester Formula: C16H16ClNO3S MolecularWeight: 337.82114

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C16H16ClNO3S/c1-21-16(20)10-6-8-18(9-7-10)15(19)14-13(17)11-4-2-3-5-12(11)22-14/h2-5,10H,6-9H2,1H3