N-[3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)phenyl]quinoline-2-carboxamide

Systemtic Name: N-[3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)phenyl]quinoline-2-carboxamide Openeye Name: N-[3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)phenyl]quinoline-2-carboxamide CAS Name: N-[3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)phenyl]-2-quinolinecarboxamide IUPAC Name: N-[3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)phenyl]quinoline-2-carboxamide Traditional Name: N-[3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)phenyl]quinaldamide Formula: C22H18N4O MolecularWeight: 354.40452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)NN=C2C3=CC(=CC=C3)NC(=O)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CC2=C(C1)NN=C2C3=CC(=CC=C3)NC(=O)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H18N4O/c27-22(20-12-11-14-5-1-2-9-18(14)24-20)23-16-7-3-6-15(13-16)21-17-8-4-10-19(17)25-26-21/h1-3,5-7,9,11-13H,4,8,10H2,(H,23,27)(H,25,26)