ethyl 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloranyl-quinazolin-2-yl]amino]ethanoate

Systemtic Name: ethyl 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloranyl-quinazolin-2-yl]amino]ethanoate Openeye Name: ethyl 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-quinazolin-2-yl]amino]acetate CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-2-quinazolinyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloroquinazolin-2-yl]amino]acetate Traditional Name: 2-[[6-chloro-4-(piperonylamino)quinazolin-2-yl]amino]acetic acid ethyl ester Formula: C20H19ClN4O4 MolecularWeight: 414.84226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=NC2=C(C=C(C=C2)Cl)C(=N1)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)CNC1=NC2=C(C=C(C=C2)Cl)C(=N1)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H19ClN4O4/c1-2-27-18(26)10-23-20-24-15-5-4-13(21)8-14(15)19(25-20)22-9-12-3-6-16-17(7-12)29-11-28-16/h3-8H,2,9-11H2,1H3,(H2,22,23,24,25)