N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-ethyl-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-ethyl-2-phenyl-quinoline-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-ethyl-2-phenyl-quinoline-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-ethyl-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-ethyl-2-phenylquinoline-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-ethyl-2-phenyl-cinchoninamide Formula: C27H24N2O3 MolecularWeight: 424.49106

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)NCC4COC5=CC=CC=C5O4

Isomeric SMILES

CCC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)NCC4COC5=CC=CC=C5O4

InChI

InChI=1S/C27H24N2O3/c1-2-20-25(27(30)28-16-19-17-31-23-14-8-9-15-24(23)32-19)21-12-6-7-13-22(21)29-26(20)18-10-4-3-5-11-18/h3-15,19H,2,16-17H2,1H3,(H,28,30)