(8-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-azanyl-5-bromanyl-benzoate

Systemtic Name: (8-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-azanyl-5-bromanyl-benzoate Openeye Name: (8-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-amino-5-bromo-benzoate CAS Name: 2-amino-5-bromobenzoic acid (8-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (8-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 2-amino-5-bromobenzoate Traditional Name: 2-amino-5-bromo-benzoic acid (4-keto-8-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C17H14BrN3O3 MolecularWeight: 388.21536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=CC(=O)N2C=C1)COC(=O)C3=C(C=CC(=C3)Br)N

Isomeric SMILES

CC1=CC2=NC(=CC(=O)N2C=C1)COC(=O)C3=C(C=CC(=C3)Br)N

InChI

InChI=1S/C17H14BrN3O3/c1-10-4-5-21-15(6-10)20-12(8-16(21)22)9-24-17(23)13-7-11(18)2-3-14(13)19/h2-8H,9,19H2,1H3