ethyl 4-(1,3-benzodioxol-5-ylmethylamino)-6,7,8-trimethoxy-quinazoline-2-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-ylmethylamino)-6,7,8-trimethoxy-quinazoline-2-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-ylmethylamino)-6,7,8-trimethoxy-quinazoline-2-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-6,7,8-trimethoxy-2-quinazolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-ylmethylamino)-6,7,8-trimethoxyquinazoline-2-carboxylate Traditional Name: 6,7,8-trimethoxy-4-(piperonylamino)quinazoline-2-carboxylic acid ethyl ester Formula: C22H23N3O7 MolecularWeight: 441.43392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C(=C(C=C2C(=N1)NCC3=CC4=C(C=C3)OCO4)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=NC2=C(C(=C(C=C2C(=N1)NCC3=CC4=C(C=C3)OCO4)OC)OC)OC

InChI

InChI=1S/C22H23N3O7/c1-5-30-22(26)21-24-17-13(9-16(27-2)18(28-3)19(17)29-4)20(25-21)23-10-12-6-7-14-15(8-12)32-11-31-14/h6-9H,5,10-11H2,1-4H3,(H,23,24,25)