4-[5-tert-butyl-2-(8-ethoxyquinolin-5-yl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[5-tert-butyl-2-(8-ethoxyquinolin-5-yl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-tert-butyl-2-(8-ethoxy-5-quinolyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-tert-butyl-2-(8-ethoxy-5-quinolinyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-tert-butyl-2-(8-ethoxyquinolin-5-yl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-tert-butyl-2-(8-ethoxy-5-quinolyl)-1H-indol-3-yl]butylamine Formula: C27H33N3O MolecularWeight: 415.57042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)C3=C(C4=C(N3)C=CC(=C4)C(C)(C)C)CCCCN)C=CC=N2

Isomeric SMILES

CCOC1=C2C(=C(C=C1)C3=C(C4=C(N3)C=CC(=C4)C(C)(C)C)CCCCN)C=CC=N2

InChI

InChI=1S/C27H33N3O/c1-5-31-24-14-12-21(19-10-8-16-29-26(19)24)25-20(9-6-7-15-28)22-17-18(27(2,3)4)11-13-23(22)30-25/h8,10-14,16-17,30H,5-7,9,15,28H2,1-4H3