2-[[2-(2-methylpropanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-prop-2-enyl-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[[2-(2-methylpropanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-prop-2-enyl-1,3-oxazole-4-carboxamide Openeye Name: N-allyl-2-[[2-(2-methylpropanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]oxazole-4-carboxamide CAS Name: 2-[[2-(2-methyl-1-oxopropyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-prop-2-enyl-4-oxazolecarboxamide IUPAC Name: 2-[[2-(2-methylpropanoyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-prop-2-enyl-1,3-oxazole-4-carboxamide Traditional Name: N-allyl-2-[(2-isobutyryl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]oxazole-4-carboxamide Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC4=NC(=CO4)C(=O)NCC=C

Isomeric SMILES

CC(C)C(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC4=NC(=CO4)C(=O)NCC=C

InChI

InChI=1S/C27H29N3O4/c1-4-13-28-26(31)23-16-34-24(29-23)17-33-21-11-10-19-12-14-30(27(32)18(2)3)25(22(19)15-21)20-8-6-5-7-9-20/h4-11,15-16,18,25H,1,12-14,17H2,2-3H3,(H,28,31)