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4-[[(4-oxidanylidenepyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzoic acid

4-[[(4-oxidanylidenepyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzoic acid

Systemtic Name:4-[[(4-oxidanylidenepyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzoic acid
Openeye Name:4-[[(4-oxopyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzoic acid
CAS Name:4-[[(4-oxo-3-pyrido[1,2-a]pyrimidinyl)amino]methyl]benzoic acid
IUPAC Name:4-[[(4-oxopyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzoic acid
Traditional Name:4-[[(4-ketopyrido[1,2-a]pyrimidin-3-yl)amino]methyl]benzoic acid
Formula: C16H13N3O3
MolecularWeight: 295.29272
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC=C(C(=O)N2C=C1)NCC3=CC=C(C=C3)C(=O)O


Isomeric SMILES

C1=CC2=NC=C(C(=O)N2C=C1)NCC3=CC=C(C=C3)C(=O)O


InChI

InChI=1S/C16H13N3O3/c20-15-13(10-18-14-3-1-2-8-19(14)15)17-9-11-4-6-12(7-5-11)16(21)22/h1-8,10,17H,9H2,(H,21,22)


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