tert-butyl N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propyl]-N-quinolin-3-ylcarbonyl-carbamate

Systemtic Name: tert-butyl N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propyl]-N-quinolin-3-ylcarbonyl-carbamate Openeye Name: tert-butyl N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propyl]-N-(quinoline-3-carbonyl)carbamate CAS Name: N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propyl]-N-[oxo(3-quinolinyl)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propyl]-N-(quinoline-3-carbonyl)carbamate Traditional Name: N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propyl]-N-(quinoline-3-carbonyl)carbamic acid tert-butyl ester Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCNCC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCNCC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C27H31N3O5/c1-27(2,3)35-26(32)30(25(31)21-16-20-7-4-5-8-22(20)29-18-21)12-6-11-28-17-19-9-10-23-24(15-19)34-14-13-33-23/h4-5,7-10,15-16,18,28H,6,11-14,17H2,1-3H3