prop-2-enyl N-[6-[2-[(2S)-piperidin-2-yl]ethoxy]isoquinolin-1-yl]carbamate

Systemtic Name: prop-2-enyl N-[6-[2-[(2S)-piperidin-2-yl]ethoxy]isoquinolin-1-yl]carbamate Openeye Name: allyl N-[6-[2-[(2S)-2-piperidyl]ethoxy]-1-isoquinolyl]carbamate CAS Name: N-[6-[2-[(2S)-2-piperidinyl]ethoxy]-1-isoquinolinyl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[6-[2-[(2S)-piperidin-2-yl]ethoxy]isoquinolin-1-yl]carbamate Traditional Name: N-[6-[2-[(2S)-2-piperidyl]ethoxy]-1-isoquinolyl]carbamic acid allyl ester Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NC1=NC=CC2=C1C=CC(=C2)OCCC3CCCCN3

Isomeric SMILES

C=CCOC(=O)NC1=NC=CC2=C1C=CC(=C2)OCC[C@@H]3CCCCN3

InChI

InChI=1S/C20H25N3O3/c1-2-12-26-20(24)23-19-18-7-6-17(14-15(18)8-11-22-19)25-13-9-16-5-3-4-10-21-16/h2,6-8,11,14,16,21H,1,3-5,9-10,12-13H2,(H,22,23,24)/t16-/m0/s1