(2-methoxy-9,10-dihydrophenanthren-3-yl)methyl-dimethyl-(phenylsulfanylmethyl)azanium

Systemtic Name: (2-methoxy-9,10-dihydrophenanthren-3-yl)methyl-dimethyl-(phenylsulfanylmethyl)azanium Openeye Name: (2-methoxy-9,10-dihydrophenanthren-3-yl)methyl-dimethyl-(phenylsulfanylmethyl)ammonium CAS Name: (2-methoxy-9,10-dihydrophenanthren-3-yl)methyl-dimethyl-[(phenylthio)methyl]ammonium IUPAC Name: (2-methoxy-9,10-dihydrophenanthren-3-yl)methyl-dimethyl-(phenylsulfanylmethyl)azanium Traditional Name: (2-methoxy-9,10-dihydrophenanthren-3-yl)methyl-dimethyl-[(phenylthio)methyl]ammonium Formula: C25H28NOS+ MolecularWeight: 390.56092

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=C(C=C2CCC3=CC=CC=C3C2=C1)OC)CSC4=CC=CC=C4

Isomeric SMILES

C[N+](C)(CC1=C(C=C2CCC3=CC=CC=C3C2=C1)OC)CSC4=CC=CC=C4

InChI

InChI=1S/C25H28NOS/c1-26(2,18-28-22-10-5-4-6-11-22)17-21-15-24-20(16-25(21)27-3)14-13-19-9-7-8-12-23(19)24/h4-12,15-16H,13-14,17-18H2,1-3H3/q+1