2-(furan-2-ylcarbonyl)-N-[2-(2-methylpropanoylamino)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(furan-2-ylcarbonyl)-N-[2-(2-methylpropanoylamino)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(furan-2-carbonyl)-N-[2-(2-methylpropanoylamino)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-furanyl(oxo)methyl]-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(furan-2-carbonyl)-N-[2-(2-methylpropanoylamino)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2-furoyl)-N-[2-(isobutyrylamino)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC=CO3

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1CC2=CC=CC=C2CN1C(=O)C3=CC=CO3

InChI

InChI=1S/C21H25N3O4/c1-14(2)19(25)22-9-10-23-20(26)17-12-15-6-3-4-7-16(15)13-24(17)21(27)18-8-5-11-28-18/h3-8,11,14,17H,9-10,12-13H2,1-2H3,(H,22,25)(H,23,26)