N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-11-oxo-pyrido[2,1-b]quinazoline-8-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-11-oxo-8-pyrido[2,1-b]quinazolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-11-oxopyrido[2,1-b]quinazoline-8-carboxamide Traditional Name: 2-chloro-11-keto-N-piperonyl-pyrido[2,1-b]quinazoline-8-carboxamide Formula: C21H14ClN3O4 MolecularWeight: 407.80656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CN4C(=NC5=C(C4=O)C=C(C=C5)Cl)C=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CN4C(=NC5=C(C4=O)C=C(C=C5)Cl)C=C3

InChI

InChI=1S/C21H14ClN3O4/c22-14-3-4-16-15(8-14)21(27)25-10-13(2-6-19(25)24-16)20(26)23-9-12-1-5-17-18(7-12)29-11-28-17/h1-8,10H,9,11H2,(H,23,26)