2,7-dimethoxy-9-[(4-nitrophenyl)methylsulfanyl]acridine

Systemtic Name: 2,7-dimethoxy-9-[(4-nitrophenyl)methylsulfanyl]acridine Openeye Name: 2,7-dimethoxy-9-[(4-nitrophenyl)methylsulfanyl]acridine CAS Name: 2,7-dimethoxy-9-[(4-nitrophenyl)methylthio]acridine IUPAC Name: 2,7-dimethoxy-9-[(4-nitrophenyl)methylsulfanyl]acridine Traditional Name: 2,7-dimethoxy-9-[(4-nitrobenzyl)thio]acridine Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C3C=CC(=CC3=C2SCC4=CC=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C3C=CC(=CC3=C2SCC4=CC=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C22H18N2O4S/c1-27-16-7-9-20-18(11-16)22(19-12-17(28-2)8-10-21(19)23-20)29-13-14-3-5-15(6-4-14)24(25)26/h3-12H,13H2,1-2H3