3-methyl-5-(1-oxidanidylpyridin-1-ium-2-yl)-8-phenylsulfanyl-3,4-dihydro-2H-naphthalen-1-one

Systemtic Name: 3-methyl-5-(1-oxidanidylpyridin-1-ium-2-yl)-8-phenylsulfanyl-3,4-dihydro-2H-naphthalen-1-one Openeye Name: 3-methyl-5-(1-oxidopyridin-1-ium-2-yl)-8-phenylsulfanyl-tetralin-1-one CAS Name: 3-methyl-5-(1-oxido-2-pyridin-1-iumyl)-8-(phenylthio)-3,4-dihydro-2H-naphthalen-1-one IUPAC Name: 3-methyl-5-(1-oxidopyridin-1-ium-2-yl)-8-phenylsulfanyl-3,4-dihydro-2H-naphthalen-1-one Traditional Name: 3-methyl-5-(1-oxidopyridin-1-ium-2-yl)-8-(phenylthio)tetralin-1-one Formula: C22H19NO2S MolecularWeight: 361.45676

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=CC(=C2C(=O)C1)SC3=CC=CC=C3)C4=CC=CC=[N+]4[O-]

Isomeric SMILES

CC1CC2=C(C=CC(=C2C(=O)C1)SC3=CC=CC=C3)C4=CC=CC=[N+]4[O-]

InChI

InChI=1S/C22H19NO2S/c1-15-13-18-17(19-9-5-6-12-23(19)25)10-11-21(22(18)20(24)14-15)26-16-7-3-2-4-8-16/h2-12,15H,13-14H2,1H3