(phenylmethyl) 4-(oxan-4-ylamino)cyclopent-2-ene-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(oxan-4-ylamino)cyclopent-2-ene-1-carboxylate Openeye Name: benzyl 4-(tetrahydropyran-4-ylamino)cyclopent-2-ene-1-carboxylate CAS Name: 4-(4-oxanylamino)-1-cyclopent-2-enecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(oxan-4-ylamino)cyclopent-2-ene-1-carboxylate Traditional Name: 4-(tetrahydropyran-4-ylamino)cyclopent-2-ene-1-carboxylic acid benzyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NC2CC(C=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1COCCC1NC2CC(C=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H23NO3/c20-18(22-13-14-4-2-1-3-5-14)15-6-7-17(12-15)19-16-8-10-21-11-9-16/h1-7,15-17,19H,8-13H2