(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl-[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-azanium

Systemtic Name: (7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl-[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: (7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl-[2-(ethoxycarbonylamino)-2-oxo-ethyl]-ethyl-ammonium CAS Name: (7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl-[2-(ethoxycarbonylamino)-2-oxoethyl]-ethylammonium IUPAC Name: (7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl-[2-(ethoxycarbonylamino)-2-oxoethyl]-ethylazanium Traditional Name: (7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl-[2-(carbethoxyamino)-2-keto-ethyl]-ethyl-ammonium Formula: C16H20BrN4O4+ MolecularWeight: 412.2584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=O)N2C=C(C=CC2=N1)Br)CC(=O)NC(=O)OCC

Isomeric SMILES

CC[NH+](CC1=CC(=O)N2C=C(C=CC2=N1)Br)CC(=O)NC(=O)OCC

InChI

InChI=1S/C16H19BrN4O4/c1-3-20(10-14(22)19-16(24)25-4-2)9-12-7-15(23)21-8-11(17)5-6-13(21)18-12/h5-8H,3-4,9-10H2,1-2H3,(H,19,22,24)/p+1