N-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-methyl-2-[(5-nitrofuran-2-yl)methyl]-6-oxidanyl-1H-isoquinoline-4-carboxamide

Systemtic Name: N-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-methyl-2-[(5-nitrofuran-2-yl)methyl]-6-oxidanyl-1H-isoquinoline-4-carboxamide Openeye Name: N-(3,5-dimethylisoxazol-4-yl)-6-hydroxy-7-methoxy-1-methyl-2-[(5-nitro-2-furyl)methyl]-1H-isoquinoline-4-carboxamide CAS Name: N-(3,5-dimethyl-4-isoxazolyl)-6-hydroxy-7-methoxy-1-methyl-2-[(5-nitro-2-furanyl)methyl]-1H-isoquinoline-4-carboxamide IUPAC Name: N-(3,5-dimethyl-1,2-oxazol-4-yl)-6-hydroxy-7-methoxy-1-methyl-2-[(5-nitrofuran-2-yl)methyl]-1H-isoquinoline-4-carboxamide Traditional Name: N-(3,5-dimethylisoxazol-4-yl)-6-hydroxy-7-methoxy-1-methyl-2-[(5-nitro-2-furyl)methyl]-1H-isoquinoline-4-carboxamide Formula: C22H22N4O7 MolecularWeight: 454.43268

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2C(=CN1CC3=CC=C(O3)[N+](=O)[O-])C(=O)NC4=C(ON=C4C)C)O)OC

Isomeric SMILES

CC1C2=CC(=C(C=C2C(=CN1CC3=CC=C(O3)[N+](=O)[O-])C(=O)NC4=C(ON=C4C)C)O)OC

InChI

InChI=1S/C22H22N4O7/c1-11-21(13(3)33-24-11)23-22(28)17-10-25(9-14-5-6-20(32-14)26(29)30)12(2)15-8-19(31-4)18(27)7-16(15)17/h5-8,10,12,27H,9H2,1-4H3,(H,23,28)