methyl (3aR,4R,7aS)-6-(hydroxymethyl)-4-methyl-2-phenyl-5,7a-dihydro-4H-1,3-benzoxazole-3a-carboxylate

Systemtic Name: methyl (3aR,4R,7aS)-6-(hydroxymethyl)-4-methyl-2-phenyl-5,7a-dihydro-4H-1,3-benzoxazole-3a-carboxylate Openeye Name: methyl (3aR,4R,7aS)-6-(hydroxymethyl)-4-methyl-2-phenyl-5,7a-dihydro-4H-1,3-benzoxazole-3a-carboxylate CAS Name: (3aR,4R,7aS)-6-(hydroxymethyl)-4-methyl-2-phenyl-5,7a-dihydro-4H-1,3-benzoxazole-3a-carboxylic acid methyl ester IUPAC Name: methyl (3aR,4R,7aS)-6-(hydroxymethyl)-4-methyl-2-phenyl-5,7a-dihydro-4H-1,3-benzoxazole-3a-carboxylate Traditional Name: (3aR,4R,7aS)-4-methyl-6-methylol-2-phenyl-5,7a-dihydro-4H-1,3-benzoxazole-3a-carboxylic acid methyl ester Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC2C1(N=C(O2)C3=CC=CC=C3)C(=O)OC)CO

Isomeric SMILES

C[C@@H]1CC(=C[C@H]2[C@@]1(N=C(O2)C3=CC=CC=C3)C(=O)OC)CO

InChI

InChI=1S/C17H19NO4/c1-11-8-12(10-19)9-14-17(11,16(20)21-2)18-15(22-14)13-6-4-3-5-7-13/h3-7,9,11,14,19H,8,10H2,1-2H3/t11-,14+,17-/m1/s1