1-heptyl-4-[[(2R)-2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]amino]piperidine-3-carboxamide

Systemtic Name: 1-heptyl-4-[[(2R)-2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]amino]piperidine-3-carboxamide Openeye Name: 1-heptyl-4-[[(2R)-2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]amino]piperidine-3-carboxamide CAS Name: 1-heptyl-4-[[(2R)-2-hydroxy-2-(6-methoxy-4-quinolinyl)ethyl]amino]-3-piperidinecarboxamide IUPAC Name: 1-heptyl-4-[[(2R)-2-hydroxy-2-(6-methoxyquinolin-4-yl)ethyl]amino]piperidine-3-carboxamide Traditional Name: 1-heptyl-4-[[(2R)-2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]amino]nipecotamide Formula: C25H38N4O3 MolecularWeight: 442.59422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCC(C(C1)C(=O)N)NCC(C2=C3C=C(C=CC3=NC=C2)OC)O

Isomeric SMILES

CCCCCCCN1CCC(C(C1)C(=O)N)NC[C@@H](C2=C3C=C(C=CC3=NC=C2)OC)O

InChI

InChI=1S/C25H38N4O3/c1-3-4-5-6-7-13-29-14-11-23(21(17-29)25(26)31)28-16-24(30)19-10-12-27-22-9-8-18(32-2)15-20(19)22/h8-10,12,15,21,23-24,28,30H,3-7,11,13-14,16-17H2,1-2H3,(H2,26,31)/t21?,23?,24-/m0/s1