8-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-2-methyl-quinoline

Systemtic Name: 8-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-2-methyl-quinoline Openeye Name: 8-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-2-methyl-quinoline CAS Name: 8-[(4-methoxy-3-nitrophenyl)methylthio]-2-methylquinoline IUPAC Name: 8-[(4-methoxy-3-nitrophenyl)methylsulfanyl]-2-methylquinoline Traditional Name: 8-[(4-methoxy-3-nitro-benzyl)thio]-2-methyl-quinoline Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2SCC3=CC(=C(C=C3)OC)[N+](=O)[O-])C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2SCC3=CC(=C(C=C3)OC)[N+](=O)[O-])C=C1

InChI

InChI=1S/C18H16N2O3S/c1-12-6-8-14-4-3-5-17(18(14)19-12)24-11-13-7-9-16(23-2)15(10-13)20(21)22/h3-10H,11H2,1-2H3