azocan-1-yl-[(3R)-2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinolin-3-yl]methanone

Systemtic Name: azocan-1-yl-[(3R)-2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinolin-3-yl]methanone Openeye Name: azocan-1-yl-[(3R)-2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinolin-3-yl]methanone CAS Name: 1-azocanyl-[(3R)-2-[2-furanyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]methanone IUPAC Name: azocan-1-yl-[(3R)-2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinolin-3-yl]methanone Traditional Name: azocan-1-yl-[(3R)-2-(2-furoyl)-3,4-dihydro-1H-isoquinolin-3-yl]methanone Formula: C22H26N2O3 MolecularWeight: 366.45344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CO4

Isomeric SMILES

C1CCCN(CCC1)C(=O)[C@H]2CC3=CC=CC=C3CN2C(=O)C4=CC=CO4

InChI

InChI=1S/C22H26N2O3/c25-21(23-12-6-2-1-3-7-13-23)19-15-17-9-4-5-10-18(17)16-24(19)22(26)20-11-8-14-27-20/h4-5,8-11,14,19H,1-3,6-7,12-13,15-16H2/t19-/m1/s1