5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2-tetrahydropyran-2-ylethyl)isoxazole-3-carboxamide CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-(2-oxanyl)ethyl]-3-isoxazolecarboxamide IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2-tetrahydropyran-2-ylethyl)isoxazole-3-carboxamide Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CCNC(=O)C2=NOC(=C2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCOC(C1)CCNC(=O)C2=NOC(=C2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H27N3O3/c25-21(22-10-8-18-7-3-4-12-26-18)20-13-19(27-23-20)15-24-11-9-16-5-1-2-6-17(16)14-24/h1-2,5-6,13,18H,3-4,7-12,14-15H2,(H,22,25)