tert-butyl (2S)-2-[(E,4S)-3-oxidanylidene-4-(phenylmethoxymethoxy)pent-1-enyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(E,4S)-3-oxidanylidene-4-(phenylmethoxymethoxy)pent-1-enyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(E,4S)-4-(benzyloxymethoxy)-3-oxo-pent-1-enyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(E,4S)-3-oxo-4-(phenylmethoxymethoxy)pent-1-enyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(E,4S)-3-oxo-4-(phenylmethoxymethoxy)pent-1-enyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(E,4S)-4-(benzoxymethoxy)-3-keto-pent-1-enyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C22H31NO5 MolecularWeight: 389.48524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C=CC1CCCN1C(=O)OC(C)(C)C)OCOCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)/C=C/[C@@H]1CCCN1C(=O)OC(C)(C)C)OCOCC2=CC=CC=C2

InChI

InChI=1S/C22H31NO5/c1-17(27-16-26-15-18-9-6-5-7-10-18)20(24)13-12-19-11-8-14-23(19)21(25)28-22(2,3)4/h5-7,9-10,12-13,17,19H,8,11,14-16H2,1-4H3/b13-12+/t17-,19-/m0/s1