N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-ethenyl-2-[(5-nitrofuran-2-yl)methyl]-7-oxidanyl-1H-isoquinoline-4-carboxamide

Systemtic Name: N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-ethenyl-2-[(5-nitrofuran-2-yl)methyl]-7-oxidanyl-1H-isoquinoline-4-carboxamide Openeye Name: N-(3,5-dimethylisoxazol-4-yl)-7-hydroxy-2-[(5-nitro-2-furyl)methyl]-1-vinyl-1H-isoquinoline-4-carboxamide CAS Name: N-(3,5-dimethyl-4-isoxazolyl)-1-ethenyl-7-hydroxy-2-[(5-nitro-2-furanyl)methyl]-1H-isoquinoline-4-carboxamide IUPAC Name: N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-ethenyl-7-hydroxy-2-[(5-nitrofuran-2-yl)methyl]-1H-isoquinoline-4-carboxamide Traditional Name: N-(3,5-dimethylisoxazol-4-yl)-7-hydroxy-2-[(5-nitro-2-furyl)methyl]-1-vinyl-1H-isoquinoline-4-carboxamide Formula: C22H20N4O6 MolecularWeight: 436.4174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)NC(=O)C2=CN(C(C3=C2C=CC(=C3)O)C=C)CC4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)NC(=O)C2=CN(C(C3=C2C=CC(=C3)O)C=C)CC4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O6/c1-4-19-17-9-14(27)5-7-16(17)18(22(28)23-21-12(2)24-32-13(21)3)11-25(19)10-15-6-8-20(31-15)26(29)30/h4-9,11,19,27H,1,10H2,2-3H3,(H,23,28)