N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-2-propan-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-2-propan-2-yl-quinoline-4-carboxamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-2-isopropyl-N-methyl-quinoline-4-carboxamide CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-2-propan-2-yl-4-quinolinecarboxamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-2-propan-2-ylquinoline-4-carboxamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-2-isopropyl-N-methyl-cinchoninamide Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)N(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)N(C)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H20ClN3O3/c1-13(2)20-11-17(16-6-4-5-7-19(16)23-20)21(26)24(3)12-14-10-15(25(27)28)8-9-18(14)22/h4-11,13H,12H2,1-3H3