SpectraBase Compound ID | FvzW8lil1gb |
---|---|
InChI | InChI=1S/C19H17NO4/c1-23-18(21)15-10-20-11-16(19(22)24-2)17(15)14-8-7-12-5-3-4-6-13(12)9-14/h3-11,17,20H,1-2H3 |
InChIKey | GCLLIBBAWYTXAW-UHFFFAOYSA-N |
Mol Weight | 323.35 g/mol |
Molecular Formula | C19H17NO4 |
Exact Mass | 323.115758 g/mol |
SpectraBase Spectrum ID | 90sjob0HMPY |
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Name | 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2-naphthalenyl)-, dimethyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 323.115758027 u |
Formula | C19H17NO4 |
InChI | InChI=1S/C19H17NO4/c1-23-18(21)15-10-20-11-16(19(22)24-2)17(15)14-8-7-12-5-3-4-6-13(12)9-14/h3-11,17,20H,1-2H3 |
InChIKey | GCLLIBBAWYTXAW-UHFFFAOYSA-N |
SMILES | N1C=C(C(C(=C1)C(=O)OC)C1=CC2=CC=CC=C2C=C1)C(=O)OC |