(3S)-2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-[[3-(4-methoxyphenyl)isoxazol-5-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-[[3-(4-methoxyphenyl)-5-isoxazolyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-2-[[3-(4-methoxyphenyl)isoxazol-5-yl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=C2)CN3CC4=CC=CC=C4CC3C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=C2)CN3CC4=CC=CC=C4C[C@H]3C(=O)N

InChI

InChI=1S/C21H21N3O3/c1-26-17-8-6-14(7-9-17)19-11-18(27-23-19)13-24-12-16-5-3-2-4-15(16)10-20(24)21(22)25/h2-9,11,20H,10,12-13H2,1H3,(H2,22,25)/t20-/m0/s1