dimethyl (1R,4R)-2-phenylazanyl-7-oxabicyclo[2.2.1]hept-5-ene-4,5-dicarboxylate

Systemtic Name: dimethyl (1R,4R)-2-phenylazanyl-7-oxabicyclo[2.2.1]hept-5-ene-4,5-dicarboxylate Openeye Name: dimethyl (1R,4R)-2-anilino-7-oxabicyclo[2.2.1]hept-5-ene-4,5-dicarboxylate CAS Name: (1R,4R)-2-anilino-7-oxabicyclo[2.2.1]hept-5-ene-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1R,4R)-2-anilino-7-oxabicyclo[2.2.1]hept-5-ene-4,5-dicarboxylate Traditional Name: (1R,4R)-2-anilino-7-oxabicyclo[2.2.1]hept-5-ene-4,5-dicarboxylic acid dimethyl ester Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2C(CC1(O2)C(=O)OC)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C[C@@H]2C(C[C@]1(O2)C(=O)OC)NC3=CC=CC=C3

InChI

InChI=1S/C16H17NO5/c1-20-14(18)11-8-13-12(17-10-6-4-3-5-7-10)9-16(11,22-13)15(19)21-2/h3-8,12-13,17H,9H2,1-2H3/t12?,13-,16-/m1/s1