ethyl 2-(heptanoylamino)-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-(heptanoylamino)-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(heptanoylamino)benzothiophene-3-carboxylate CAS Name: 2-(1-oxoheptylamino)-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(heptanoylamino)-1-benzothiophene-3-carboxylate Traditional Name: 2-(enanthylamino)benzothiophene-3-carboxylic acid ethyl ester Formula: C18H23NO3S MolecularWeight: 333.44512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=C(C2=CC=CC=C2S1)C(=O)OCC

Isomeric SMILES

CCCCCCC(=O)NC1=C(C2=CC=CC=C2S1)C(=O)OCC

InChI

InChI=1S/C18H23NO3S/c1-3-5-6-7-12-15(20)19-17-16(18(21)22-4-2)13-10-8-9-11-14(13)23-17/h8-11H,3-7,12H2,1-2H3,(H,19,20)