ethyl (3S,3aR,7aS)-3-acetyloxy-2-ethoxy-5-methyl-7a-phenyl-4,7-dihydro-3H-indole-3a-carboxylate

Systemtic Name: ethyl (3S,3aR,7aS)-3-acetyloxy-2-ethoxy-5-methyl-7a-phenyl-4,7-dihydro-3H-indole-3a-carboxylate Openeye Name: ethyl (3S,3aR,7aS)-3-acetoxy-2-ethoxy-5-methyl-7a-phenyl-4,7-dihydro-3H-indole-3a-carboxylate CAS Name: (3S,3aR,7aS)-3-acetyloxy-2-ethoxy-5-methyl-7a-phenyl-4,7-dihydro-3H-indole-3a-carboxylic acid ethyl ester IUPAC Name: ethyl (3S,3aR,7aS)-3-acetyloxy-2-ethoxy-5-methyl-7a-phenyl-4,7-dihydro-3H-indole-3a-carboxylate Traditional Name: (3S,3aR,7aS)-3-acetoxy-2-ethoxy-5-methyl-7a-phenyl-4,7-dihydro-3H-indole-3a-carboxylic acid ethyl ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2(CC=C(CC2(C1OC(=O)C)C(=O)OCC)C)C3=CC=CC=C3

Isomeric SMILES

CCOC1=N[C@@]2(CC=C(C[C@@]2([C@@H]1OC(=O)C)C(=O)OCC)C)C3=CC=CC=C3

InChI

InChI=1S/C22H27NO5/c1-5-26-19-18(28-16(4)24)21(20(25)27-6-2)14-15(3)12-13-22(21,23-19)17-10-8-7-9-11-17/h7-12,18H,5-6,13-14H2,1-4H3/t18-,21-,22+/m1/s1