2-[cyclohexyl(methyl)amino]-N-methyl-N-prop-2-ynyl-quinoline-4-carboxamide

Systemtic Name: 2-[cyclohexyl(methyl)amino]-N-methyl-N-prop-2-ynyl-quinoline-4-carboxamide Openeye Name: 2-[cyclohexyl(methyl)amino]-N-methyl-N-prop-2-ynyl-quinoline-4-carboxamide CAS Name: 2-[cyclohexyl(methyl)amino]-N-methyl-N-prop-2-ynyl-4-quinolinecarboxamide IUPAC Name: 2-[cyclohexyl(methyl)amino]-N-methyl-N-prop-2-ynylquinoline-4-carboxamide Traditional Name: 2-[cyclohexyl(methyl)amino]-N-methyl-N-propargyl-cinchoninamide Formula: C21H25N3O MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#C)C(=O)C1=CC(=NC2=CC=CC=C21)N(C)C3CCCCC3

Isomeric SMILES

CN(CC#C)C(=O)C1=CC(=NC2=CC=CC=C21)N(C)C3CCCCC3

InChI

InChI=1S/C21H25N3O/c1-4-14-23(2)21(25)18-15-20(22-19-13-9-8-12-17(18)19)24(3)16-10-6-5-7-11-16/h1,8-9,12-13,15-16H,5-7,10-11,14H2,2-3H3