tert-butyl 4-[2-oxidanylidene-2-[[2-(3-oxidanylidene-3-phenylmethoxy-propyl)-3,4-dihydro-1H-isoquinolin-1-yl]amino]ethoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-oxidanylidene-2-[[2-(3-oxidanylidene-3-phenylmethoxy-propyl)-3,4-dihydro-1H-isoquinolin-1-yl]amino]ethoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[[2-(3-benzyloxy-3-oxo-propyl)-3,4-dihydro-1H-isoquinolin-1-yl]amino]-2-oxo-ethoxy]piperidine-1-carboxylate CAS Name: 4-[2-oxo-2-[[2-(3-oxo-3-phenylmethoxypropyl)-3,4-dihydro-1H-isoquinolin-1-yl]amino]ethoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-oxo-2-[[2-(3-oxo-3-phenylmethoxypropyl)-3,4-dihydro-1H-isoquinolin-1-yl]amino]ethoxy]piperidine-1-carboxylate Traditional Name: 4-[2-[[2-(3-benzoxy-3-keto-propyl)-3,4-dihydro-1H-isoquinolin-1-yl]amino]-2-keto-ethoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C31H41N3O6 MolecularWeight: 551.67374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OCC(=O)NC2C3=CC=CC=C3CCN2CCC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OCC(=O)NC2C3=CC=CC=C3CCN2CCC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H41N3O6/c1-31(2,3)40-30(37)34-18-14-25(15-19-34)38-22-27(35)32-29-26-12-8-7-11-24(26)13-17-33(29)20-16-28(36)39-21-23-9-5-4-6-10-23/h4-12,25,29H,13-22H2,1-3H3,(H,32,35)