4-[[2-(1-cyclobutylpiperidin-4-yl)-1-oxidanylidene-3,4-dihydroisoquinolin-6-yl]oxy]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[2-(1-cyclobutylpiperidin-4-yl)-1-oxidanylidene-3,4-dihydroisoquinolin-6-yl]oxy]-N-cyclopropyl-benzamide Openeye Name: 4-[[2-(1-cyclobutyl-4-piperidyl)-1-oxo-3,4-dihydroisoquinolin-6-yl]oxy]-N-cyclopropyl-benzamide CAS Name: 4-[[2-(1-cyclobutyl-4-piperidinyl)-1-oxo-3,4-dihydroisoquinolin-6-yl]oxy]-N-cyclopropylbenzamide IUPAC Name: 4-[[2-(1-cyclobutylpiperidin-4-yl)-1-oxo-3,4-dihydroisoquinolin-6-yl]oxy]-N-cyclopropylbenzamide Traditional Name: 4-[[2-(1-cyclobutyl-4-piperidyl)-1-keto-3,4-dihydroisoquinolin-6-yl]oxy]-N-cyclopropyl-benzamide Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CCC(CC2)N3CCC4=C(C3=O)C=CC(=C4)OC5=CC=C(C=C5)C(=O)NC6CC6

Isomeric SMILES

C1CC(C1)N2CCC(CC2)N3CCC4=C(C3=O)C=CC(=C4)OC5=CC=C(C=C5)C(=O)NC6CC6

InChI

InChI=1S/C28H33N3O3/c32-27(29-21-6-7-21)19-4-8-24(9-5-19)34-25-10-11-26-20(18-25)12-17-31(28(26)33)23-13-15-30(16-14-23)22-2-1-3-22/h4-5,8-11,18,21-23H,1-3,6-7,12-17H2,(H,29,32)