N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-6,7,8-trimethoxy-quinazolin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-6,7,8-trimethoxy-quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-6,7,8-trimethoxy-quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-6,7,8-trimethoxy-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-6,7,8-trimethoxyquinazolin-4-amine Traditional Name: (2-chloro-6,7,8-trimethoxy-quinazolin-4-yl)-piperonyl-amine Formula: C19H18ClN3O5 MolecularWeight: 403.81632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C(=NC(=N2)Cl)NCC3=CC4=C(C=C3)OCO4)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=NC(=N2)Cl)NCC3=CC4=C(C=C3)OCO4)OC)OC

InChI

InChI=1S/C19H18ClN3O5/c1-24-14-7-11-15(17(26-3)16(14)25-2)22-19(20)23-18(11)21-8-10-4-5-12-13(6-10)28-9-27-12/h4-7H,8-9H2,1-3H3,(H,21,22,23)