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

Systemtic Name: 1-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]piperidine-4-carboxylate Openeye Name: 1-(3-chlorobenzothiophene-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-4-piperidinecarboxylate IUPAC Name: 1-(3-chloro-1-benzothiophene-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(3-chlorobenzothiophene-2-carbonyl)isonipecotate Formula: C15H13ClNO3S- MolecularWeight: 322.78662

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C15H14ClNO3S/c16-12-10-3-1-2-4-11(10)21-13(12)14(18)17-7-5-9(6-8-17)15(19)20/h1-4,9H,5-8H2,(H,19,20)/p-1