1-cyclopropyl-2-[(5-nitrofuran-2-yl)methyl]-7-oxidanyl-N-phenyl-1H-isoquinoline-4-carboxamide

Systemtic Name: 1-cyclopropyl-2-[(5-nitrofuran-2-yl)methyl]-7-oxidanyl-N-phenyl-1H-isoquinoline-4-carboxamide Openeye Name: 1-cyclopropyl-7-hydroxy-2-[(5-nitro-2-furyl)methyl]-N-phenyl-1H-isoquinoline-4-carboxamide CAS Name: 1-cyclopropyl-7-hydroxy-2-[(5-nitro-2-furanyl)methyl]-N-phenyl-1H-isoquinoline-4-carboxamide IUPAC Name: 1-cyclopropyl-7-hydroxy-2-[(5-nitrofuran-2-yl)methyl]-N-phenyl-1H-isoquinoline-4-carboxamide Traditional Name: 1-cyclopropyl-7-hydroxy-2-[(5-nitro-2-furyl)methyl]-N-phenyl-1H-isoquinoline-4-carboxamide Formula: C24H21N3O5 MolecularWeight: 431.44064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2C3=C(C=CC(=C3)O)C(=CN2CC4=CC=C(O4)[N+](=O)[O-])C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CC1C2C3=C(C=CC(=C3)O)C(=CN2CC4=CC=C(O4)[N+](=O)[O-])C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C24H21N3O5/c28-17-8-10-19-20(12-17)23(15-6-7-15)26(13-18-9-11-22(32-18)27(30)31)14-21(19)24(29)25-16-4-2-1-3-5-16/h1-5,8-12,14-15,23,28H,6-7,13H2,(H,25,29)