1-[2-(4-cyanopiperidin-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 1-[2-(4-cyanopiperidin-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Openeye Name: 1-[2-(4-cyano-4-piperidyl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid CAS Name: 1-[2-(4-cyano-4-piperidinyl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid IUPAC Name: 1-[2-(4-cyanopiperidin-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Traditional Name: 1-[2-(4-cyano-4-piperidyl)ethoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)OCCC3(CCNCC3)C#N)C(=O)O

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)OCCC3(CCNCC3)C#N)C(=O)O

InChI

InChI=1S/C18H23N3O3/c19-13-18(6-9-20-10-7-18)8-12-24-16-15-4-2-1-3-14(15)5-11-21(16)17(22)23/h1-4,16,20H,5-12H2,(H,22,23)