sodium 3-[1-(10-phenylacridin-9-ylidene)ethylsulfanyl]propane-1-sulfonate

Systemtic Name: sodium 3-[1-(10-phenylacridin-9-ylidene)ethylsulfanyl]propane-1-sulfonate Openeye Name: sodium 3-[1-(10-phenylacridin-9-ylidene)ethylsulfanyl]propane-1-sulfonate CAS Name: sodium 3-[1-(10-phenyl-9-acridinylidene)ethylthio]-1-propanesulfonate IUPAC Name: sodium 3-[1-(10-phenylacridin-9-ylidene)ethylsulfanyl]propane-1-sulfonate Traditional Name: sodium 3-[1-(10-phenylacridin-9-ylidene)ethylthio]propane-1-sulfonate Formula: C24H22NNaO3S2 MolecularWeight: 459.55615

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C2=CC=CC=C2N(C3=CC=CC=C31)C4=CC=CC=C4)SCCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(=C1C2=CC=CC=C2N(C3=CC=CC=C31)C4=CC=CC=C4)SCCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C24H23NO3S2.Na/c1-18(29-16-9-17-30(26,27)28)24-20-12-5-7-14-22(20)25(19-10-3-2-4-11-19)23-15-8-6-13-21(23)24;/h2-8,10-15H,9,16-17H2,1H3,(H,26,27,28);/q;+1/p-1