ethyl 8-[(6,7,8-trimethoxyquinazolin-4-yl)amino]octanoate

Systemtic Name: ethyl 8-[(6,7,8-trimethoxyquinazolin-4-yl)amino]octanoate Openeye Name: ethyl 8-[(6,7,8-trimethoxyquinazolin-4-yl)amino]octanoate CAS Name: 8-[(6,7,8-trimethoxy-4-quinazolinyl)amino]octanoic acid ethyl ester IUPAC Name: ethyl 8-[(6,7,8-trimethoxyquinazolin-4-yl)amino]octanoate Traditional Name: 8-[(6,7,8-trimethoxyquinazolin-4-yl)amino]caprylic acid ethyl ester Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCCNC1=NC=NC2=C(C(=C(C=C21)OC)OC)OC

Isomeric SMILES

CCOC(=O)CCCCCCCNC1=NC=NC2=C(C(=C(C=C21)OC)OC)OC

InChI

InChI=1S/C21H31N3O5/c1-5-29-17(25)11-9-7-6-8-10-12-22-21-15-13-16(26-2)19(27-3)20(28-4)18(15)23-14-24-21/h13-14H,5-12H2,1-4H3,(H,22,23,24)