7-[[3-(pyrrolidin-1-ylmethyl)phenoxy]methyl]pyrido[1,2-a]pyrazine-2-carboxylic acid

Systemtic Name: 7-[[3-(pyrrolidin-1-ylmethyl)phenoxy]methyl]pyrido[1,2-a]pyrazine-2-carboxylic acid Openeye Name: 7-[[3-(pyrrolidin-1-ylmethyl)phenoxy]methyl]pyrido[1,2-a]pyrazine-2-carboxylic acid CAS Name: 7-[[3-(1-pyrrolidinylmethyl)phenoxy]methyl]-2-pyrido[1,2-a]pyrazinecarboxylic acid IUPAC Name: 7-[[3-(pyrrolidin-1-ylmethyl)phenoxy]methyl]pyrido[1,2-a]pyrazine-2-carboxylic acid Traditional Name: 7-[[3-(pyrrolidinomethyl)phenoxy]methyl]pyrido[1,2-a]pyrazine-2-carboxylic acid Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)OCC3=CN4C=CN(C=C4C=C3)C(=O)O

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)OCC3=CN4C=CN(C=C4C=C3)C(=O)O

InChI

InChI=1S/C21H23N3O3/c25-21(26)24-11-10-23-14-18(6-7-19(23)15-24)16-27-20-5-3-4-17(12-20)13-22-8-1-2-9-22/h3-7,10-12,14-15H,1-2,8-9,13,16H2,(H,25,26)