ethyl 5-azanyl-3-[[1-chloranyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[[1-chloranyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-3-[(1-chloro-9,10-dioxo-anthracene-2-carbonyl)oxymethyl]-4-cyano-thiophene-2-carboxylate CAS Name: 5-amino-3-[[(1-chloro-9,10-dioxo-2-anthracenyl)-oxomethoxy]methyl]-4-cyano-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[(1-chloro-9,10-dioxoanthracene-2-carbonyl)oxymethyl]-4-cyanothiophene-2-carboxylate Traditional Name: 5-amino-3-[(1-chloro-9,10-diketo-anthracene-2-carbonyl)oxymethyl]-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C24H15ClN2O6S MolecularWeight: 494.9037

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C24H15ClN2O6S/c1-2-32-24(31)21-16(15(9-26)22(27)34-21)10-33-23(30)14-8-7-13-17(18(14)25)20(29)12-6-4-3-5-11(12)19(13)28/h3-8H,2,10,27H2,1H3