2-pyrrolidin-1-ylethyl 3-pentylquinoline-4-carboxylate

Systemtic Name: 2-pyrrolidin-1-ylethyl 3-pentylquinoline-4-carboxylate Openeye Name: 2-pyrrolidin-1-ylethyl 3-pentylquinoline-4-carboxylate CAS Name: 3-pentyl-4-quinolinecarboxylic acid 2-(1-pyrrolidinyl)ethyl ester IUPAC Name: 2-pyrrolidin-1-ylethyl 3-pentylquinoline-4-carboxylate Traditional Name: 3-amylcinchoninic acid 2-pyrrolidinoethyl ester Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C2=CC=CC=C2N=C1)C(=O)OCCN3CCCC3

Isomeric SMILES

CCCCCC1=C(C2=CC=CC=C2N=C1)C(=O)OCCN3CCCC3

InChI

InChI=1S/C21H28N2O2/c1-2-3-4-9-17-16-22-19-11-6-5-10-18(19)20(17)21(24)25-15-14-23-12-7-8-13-23/h5-6,10-11,16H,2-4,7-9,12-15H2,1H3