N-(4-acetamido-3-chloranyl-phenyl)-2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(4-acetamido-3-chlorophenyl)-2-[2-furanyl(oxo)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-2-(2-furoyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H20ClN3O4 MolecularWeight: 437.8756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CO4)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CO4)Cl

InChI

InChI=1S/C23H20ClN3O4/c1-14(28)25-19-9-8-17(12-18(19)24)26-22(29)20-11-15-5-2-3-6-16(15)13-27(20)23(30)21-7-4-10-31-21/h2-10,12,20H,11,13H2,1H3,(H,25,28)(H,26,29)