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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(4-methoxynaphthalen-1-yl)carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(4-methoxynaphthalene-1-carbonyl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(4-methoxy-1-naphthalenyl)-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(4-methoxynaphthalene-1-carbonyl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(4-methoxy-1-naphthoyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=C(C3=CC=CC=C32)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=C(C3=CC=CC=C32)OC

InChI

InChI=1S/C21H18N2O5S/c1-3-27-21(25)18-16(15(10-22)19(23)29-18)11-28-20(24)14-8-9-17(26-2)13-7-5-4-6-12(13)14/h4-9H,3,11,23H2,1-2H3