1-[[(3R)-2-[(5-chloranyl-2-oxidanyl-phenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]carbonyl]piperidine-4-carboxamide

Systemtic Name: 1-[[(3R)-2-[(5-chloranyl-2-oxidanyl-phenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]carbonyl]piperidine-4-carboxamide Openeye Name: 1-[(3R)-2-[(5-chloro-2-hydroxy-phenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[(3R)-2-[(5-chloro-2-hydroxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3R)-2-[(5-chloro-2-hydroxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[(3R)-2-(5-chloro-2-hydroxy-benzyl)-3,4-dihydro-1H-isoquinoline-3-carbonyl]isonipecotamide Formula: C23H26ClN3O3 MolecularWeight: 427.92384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2CC3=CC=CC=C3CN2CC4=C(C=CC(=C4)Cl)O

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)[C@H]2CC3=CC=CC=C3CN2CC4=C(C=CC(=C4)Cl)O

InChI

InChI=1S/C23H26ClN3O3/c24-19-5-6-21(28)18(11-19)14-27-13-17-4-2-1-3-16(17)12-20(27)23(30)26-9-7-15(8-10-26)22(25)29/h1-6,11,15,20,28H,7-10,12-14H2,(H2,25,29)/t20-/m1/s1