2-(furan-2-ylcarbonyl)-N-(5-methylhexan-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(furan-2-ylcarbonyl)-N-(5-methylhexan-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(1,4-dimethylpentyl)-2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-furanyl(oxo)methyl]-N-(5-methylhexan-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(furan-2-carbonyl)-N-(5-methylhexan-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(1,4-dimethylpentyl)-2-(2-furoyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC=CO3

Isomeric SMILES

CC(C)CCC(C)NC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC=CO3

InChI

InChI=1S/C22H28N2O3/c1-15(2)10-11-16(3)23-21(25)19-13-17-7-4-5-8-18(17)14-24(19)22(26)20-9-6-12-27-20/h4-9,12,15-16,19H,10-11,13-14H2,1-3H3,(H,23,25)