ethyl 5-azanyl-4-cyano-3-[(1-oxidanylnaphthalen-2-yl)carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(1-oxidanylnaphthalen-2-yl)carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(1-hydroxynaphthalene-2-carbonyl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(1-hydroxy-2-naphthalenyl)-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(1-hydroxynaphthalene-2-carbonyl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(1-hydroxy-2-naphthoyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H16N2O5S MolecularWeight: 396.41644

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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=CC=CC=C3C=C2)O

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=C(C3=CC=CC=C3C=C2)O

InChI

InChI=1S/C20H16N2O5S/c1-2-26-20(25)17-15(14(9-21)18(22)28-17)10-27-19(24)13-8-7-11-5-3-4-6-12(11)16(13)23/h3-8,23H,2,10,22H2,1H3