ethyl 2-[[1-butylsulfanyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[1-butylsulfanyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[(1-butylsulfanyl-9,10-dioxo-anthracene-2-carbonyl)amino]acetate CAS Name: 2-[[[1-(butylthio)-9,10-dioxo-2-anthracenyl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1-butylsulfanyl-9,10-dioxoanthracene-2-carbonyl)amino]acetate Traditional Name: 2-[[1-(butylthio)-9,10-diketo-anthracene-2-carbonyl]amino]acetic acid ethyl ester Formula: C23H23NO5S MolecularWeight: 425.49742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C=CC2=C1C(=O)C3=CC=CC=C3C2=O)C(=O)NCC(=O)OCC

Isomeric SMILES

CCCCSC1=C(C=CC2=C1C(=O)C3=CC=CC=C3C2=O)C(=O)NCC(=O)OCC

InChI

InChI=1S/C23H23NO5S/c1-3-5-12-30-22-17(23(28)24-13-18(25)29-4-2)11-10-16-19(22)21(27)15-9-7-6-8-14(15)20(16)26/h6-11H,3-5,12-13H2,1-2H3,(H,24,28)