ethyl 1-[(E)-3-(1H-indazol-3-yl)prop-2-enoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(E)-3-(1H-indazol-3-yl)prop-2-enoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(E)-3-(1H-indazol-3-yl)prop-2-enoyl]piperidine-4-carboxylate CAS Name: 1-[(E)-3-(1H-indazol-3-yl)-1-oxoprop-2-enyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-3-(1H-indazol-3-yl)prop-2-enoyl]piperidine-4-carboxylate Traditional Name: 1-[(E)-3-(1H-indazol-3-yl)acryloyl]isonipecotic acid ethyl ester Formula: C18H21N3O3 MolecularWeight: 327.37764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C=CC2=NNC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)/C=C/C2=NNC3=CC=CC=C32

InChI

InChI=1S/C18H21N3O3/c1-2-24-18(23)13-9-11-21(12-10-13)17(22)8-7-16-14-5-3-4-6-15(14)19-20-16/h3-8,13H,2,9-12H2,1H3,(H,19,20)/b8-7+