ethyl 4-oxidanylidene-3-propyl-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-3-propyl-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylate Openeye Name: ethyl 4-oxo-3-propyl-6-(2-thienyl)-1,5,6,7-tetrahydroindole-2-carboxylate CAS Name: 4-oxo-3-propyl-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-3-propyl-6-thiophen-2-yl-1,5,6,7-tetrahydroindole-2-carboxylate Traditional Name: 4-keto-3-propyl-6-(2-thienyl)-1,5,6,7-tetrahydroindole-2-carboxylic acid ethyl ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC2=C1C(=O)CC(C2)C3=CC=CS3)C(=O)OCC

Isomeric SMILES

CCCC1=C(NC2=C1C(=O)CC(C2)C3=CC=CS3)C(=O)OCC

InChI

InChI=1S/C18H21NO3S/c1-3-6-12-16-13(19-17(12)18(21)22-4-2)9-11(10-14(16)20)15-7-5-8-23-15/h5,7-8,11,19H,3-4,6,9-10H2,1-2H3