N-(3-ethynylphenyl)-2-propan-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-2-propan-2-yl-quinoline-4-carboxamide Openeye Name: N-(3-ethynylphenyl)-2-isopropyl-quinoline-4-carboxamide CAS Name: N-(3-ethynylphenyl)-2-propan-2-yl-4-quinolinecarboxamide IUPAC Name: N-(3-ethynylphenyl)-2-propan-2-ylquinoline-4-carboxamide Traditional Name: N-(3-ethynylphenyl)-2-isopropyl-cinchoninamide Formula: C21H18N2O MolecularWeight: 314.38042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)NC3=CC=CC(=C3)C#C

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C21H18N2O/c1-4-15-8-7-9-16(12-15)22-21(24)18-13-20(14(2)3)23-19-11-6-5-10-17(18)19/h1,5-14H,2-3H3,(H,22,24)