tert-butyl N-[3-[1-[(4-methoxyphenyl)methylamino]isoquinolin-5-yl]oxypropyl]carbamate

Systemtic Name: tert-butyl N-[3-[1-[(4-methoxyphenyl)methylamino]isoquinolin-5-yl]oxypropyl]carbamate Openeye Name: tert-butyl N-[3-[[1-[(4-methoxyphenyl)methylamino]-5-isoquinolyl]oxy]propyl]carbamate CAS Name: N-[3-[[1-[(4-methoxyphenyl)methylamino]-5-isoquinolinyl]oxy]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[1-[(4-methoxyphenyl)methylamino]isoquinolin-5-yl]oxypropyl]carbamate Traditional Name: N-[3-[[1-(p-anisylamino)-5-isoquinolyl]oxy]propyl]carbamic acid tert-butyl ester Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCOC1=CC=CC2=C1C=CN=C2NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCCOC1=CC=CC2=C1C=CN=C2NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C25H31N3O4/c1-25(2,3)32-24(29)27-14-6-16-31-22-8-5-7-21-20(22)13-15-26-23(21)28-17-18-9-11-19(30-4)12-10-18/h5,7-13,15H,6,14,16-17H2,1-4H3,(H,26,28)(H,27,29)