2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-N-[(2-nitrophenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-N-[(2-nitrophenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-N-[(2-nitrophenyl)methyl]quinoline-4-carboxamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-N-[(2-nitrophenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-N-[(2-nitrophenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-N-(2-nitrobenzyl)cinchoninamide Formula: C26H21N3O5 MolecularWeight: 455.46204

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C26H21N3O5/c1-28(16-18-6-2-5-9-23(18)29(31)32)26(30)20-15-22(27-21-8-4-3-7-19(20)21)17-10-11-24-25(14-17)34-13-12-33-24/h2-11,14-15H,12-13,16H2,1H3