2-(furan-2-ylcarbonyl)-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(furan-2-ylcarbonyl)-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(furan-2-carbonyl)-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-furanyl(oxo)methyl]-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(furan-2-carbonyl)-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2-furoyl)-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CO3)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CO3)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O5/c25-20(22-16-7-3-8-17(12-16)24(27)28)18-11-14-5-1-2-6-15(14)13-23(18)21(26)19-9-4-10-29-19/h1-10,12,18H,11,13H2,(H,22,25)