[4-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenoxy]piperidin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenoxy]piperidin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenoxy]-1-piperidyl]-(3-pyridyl)methanone CAS Name: [4-[2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenoxy]-1-piperidinyl]-(3-pyridinyl)methanone IUPAC Name: [4-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenoxy]piperidin-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenoxy]piperidino]-(3-pyridyl)methanone Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=CC=C2C(=O)N3CCC4=CC=CC=C4C3)C(=O)C5=CN=CC=C5

Isomeric SMILES

C1CN(CCC1OC2=CC=CC=C2C(=O)N3CCC4=CC=CC=C4C3)C(=O)C5=CN=CC=C5

InChI

InChI=1S/C27H27N3O3/c31-26(21-8-5-14-28-18-21)29-16-12-23(13-17-29)33-25-10-4-3-9-24(25)27(32)30-15-11-20-6-1-2-7-22(20)19-30/h1-10,14,18,23H,11-13,15-17,19H2