5-(isoquinolin-5-yloxymethyl)-N-[[(2R)-oxolan-2-yl]methyl]-N-propyl-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(isoquinolin-5-yloxymethyl)-N-[[(2R)-oxolan-2-yl]methyl]-N-propyl-1,2-oxazole-3-carboxamide Openeye Name: 5-(5-isoquinolyloxymethyl)-N-propyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]isoxazole-3-carboxamide CAS Name: 5-(5-isoquinolinyloxymethyl)-N-[[(2R)-2-oxolanyl]methyl]-N-propyl-3-isoxazolecarboxamide IUPAC Name: 5-(isoquinolin-5-yloxymethyl)-N-[[(2R)-oxolan-2-yl]methyl]-N-propyl-1,2-oxazole-3-carboxamide Traditional Name: 5-(5-isoquinolyloxymethyl)-N-propyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]isoxazole-3-carboxamide Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CCCO1)C(=O)C2=NOC(=C2)COC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CCCN(C[C@H]1CCCO1)C(=O)C2=NOC(=C2)COC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C22H25N3O4/c1-2-10-25(14-17-6-4-11-27-17)22(26)20-12-18(29-24-20)15-28-21-7-3-5-16-13-23-9-8-19(16)21/h3,5,7-9,12-13,17H,2,4,6,10-11,14-15H2,1H3/t17-/m1/s1