1,3-benzodioxol-5-ylmethyl-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]-methyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-methylazanium Traditional Name: (7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl-methyl-piperonyl-ammonium Formula: C18H17BrN3O3+ MolecularWeight: 403.24988

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCO2)CC3=CC(=O)N4C=C(C=CC4=N3)Br

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCO2)CC3=CC(=O)N4C=C(C=CC4=N3)Br

InChI

InChI=1S/C18H16BrN3O3/c1-21(8-12-2-4-15-16(6-12)25-11-24-15)10-14-7-18(23)22-9-13(19)3-5-17(22)20-14/h2-7,9H,8,10-11H2,1H3/p+1