tert-butyl 4-[2-oxidanylidene-2-[[2-(3-oxidanylidene-3-phenylmethoxy-propyl)-3,4-dihydro-1H-isoquinolin-7-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-7-yl]amino]ethoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[[2-(3-benzyloxy-3-oxo-propyl)-3,4-dihydro-1H-isoquinolin-7-yl]amino]-2-oxo-ethoxy]piperidine-1-carboxylate CAS Name: 4-[2-oxo-2-[[2-(3-oxo-3-phenylmethoxypropyl)-3,4-dihydro-1H-isoquinolin-7-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-7-yl]amino]ethoxy]piperidine-1-carboxylate Traditional Name: 4-[2-[[2-(3-benzoxy-3-keto-propyl)-3,4-dihydro-1H-isoquinolin-7-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)NC2=CC3=C(CCN(C3)CCC(=O)OCC4=CC=CC=C4)C=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OCC(=O)NC2=CC3=C(CCN(C3)CCC(=O)OCC4=CC=CC=C4)C=C2

InChI

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