1-[2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]piperidine-4-carboxamide CAS Name: 1-[[2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]piperidine-4-carboxamide Traditional Name: 1-[2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]isonipecotamide Formula: C22H24ClN3O4S MolecularWeight: 461.96166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

InChI

InChI=1S/C22H24ClN3O4S/c23-20-6-5-18(13-19(20)22(28)25-10-7-16(8-11-25)21(24)27)31(29,30)26-12-9-15-3-1-2-4-17(15)14-26/h1-6,13,16H,7-12,14H2,(H2,24,27)