ethyl (2S,3aS)-2-(methylcarbamoyl)-4,5-dihydro-3aH-benzo[e][1]benzofuran-2-carboxylate

Systemtic Name: ethyl (2S,3aS)-2-(methylcarbamoyl)-4,5-dihydro-3aH-benzo[e][1]benzofuran-2-carboxylate Openeye Name: ethyl (2S,3aS)-2-(methylcarbamoyl)-4,5-dihydro-3aH-benzo[e]benzofuran-2-carboxylate CAS Name: (2S,3aS)-2-(methylcarbamoyl)-4,5-dihydro-3aH-benzo[e]benzofuran-2-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,3aS)-2-(methylcarbamoyl)-4,5-dihydro-3aH-benzo[e][1]benzofuran-2-carboxylate Traditional Name: (2S,3aS)-2-(methylcarbamoyl)-4,5-dihydro-3aH-benzo[e]benzofuran-2-carboxylic acid ethyl ester Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C=C2C(O1)CCC3=CC=CC=C32)C(=O)NC

Isomeric SMILES

CCOC(=O)[C@]1(C=C2[C@@H](O1)CCC3=CC=CC=C32)C(=O)NC

InChI

InChI=1S/C17H19NO4/c1-3-21-16(20)17(15(19)18-2)10-13-12-7-5-4-6-11(12)8-9-14(13)22-17/h4-7,10,14H,3,8-9H2,1-2H3,(H,18,19)/t14-,17-/m0/s1