ethyl (3aR,7aS)-2-ethoxy-5-methyl-3-oxidanylidene-7a-phenyl-4,7-dihydroindole-3a-carboxylate

Systemtic Name: ethyl (3aR,7aS)-2-ethoxy-5-methyl-3-oxidanylidene-7a-phenyl-4,7-dihydroindole-3a-carboxylate Openeye Name: ethyl (3aR,7aS)-2-ethoxy-5-methyl-3-oxo-7a-phenyl-4,7-dihydroindole-3a-carboxylate CAS Name: (3aR,7aS)-2-ethoxy-5-methyl-3-oxo-7a-phenyl-4,7-dihydroindole-3a-carboxylic acid ethyl ester IUPAC Name: ethyl (3aR,7aS)-2-ethoxy-5-methyl-3-oxo-7a-phenyl-4,7-dihydroindole-3a-carboxylate Traditional Name: (3aR,7aS)-2-ethoxy-3-keto-5-methyl-7a-phenyl-4,7-dihydroindole-3a-carboxylic acid ethyl ester Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2(CC=C(CC2(C1=O)C(=O)OCC)C)C3=CC=CC=C3

Isomeric SMILES

CCOC1=N[C@@]2(CC=C(C[C@@]2(C1=O)C(=O)OCC)C)C3=CC=CC=C3

InChI

InChI=1S/C20H23NO4/c1-4-24-17-16(22)19(18(23)25-5-2)13-14(3)11-12-20(19,21-17)15-9-7-6-8-10-15/h6-11H,4-5,12-13H2,1-3H3/t19-,20+/m1/s1