ethyl 2-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4,4-dimethyl-2,6-dioxo-cyclohexylidene)methylamino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC=C2C(=O)CC(CC2=O)(C)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC=C2C(=O)CC(CC2=O)(C)C)C(=O)OCC

InChI

InChI=1S/C18H23NO4S/c1-5-11-7-12(17(22)23-6-2)16(24-11)19-10-13-14(20)8-18(3,4)9-15(13)21/h7,10,19H,5-6,8-9H2,1-4H3