tert-butyl (3S)-3-[4-(3-ethoxy-3-oxidanylidene-prop-1-en-2-yl)phenoxy]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (3S)-3-[4-(3-ethoxy-3-oxidanylidene-prop-1-en-2-yl)phenoxy]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (3S)-3-[4-(1-ethoxycarbonylvinyl)phenoxy]pyrrolidine-1-carboxylate CAS Name: (3S)-3-[4-(3-ethoxy-3-oxoprop-1-en-2-yl)phenoxy]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-[4-(3-ethoxy-3-oxoprop-1-en-2-yl)phenoxy]pyrrolidine-1-carboxylate Traditional Name: (3S)-3-[4-(1-carbethoxyvinyl)phenoxy]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H27NO5 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C)C1=CC=C(C=C1)OC2CCN(C2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(=C)C1=CC=C(C=C1)O[C@H]2CCN(C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H27NO5/c1-6-24-18(22)14(2)15-7-9-16(10-8-15)25-17-11-12-21(13-17)19(23)26-20(3,4)5/h7-10,17H,2,6,11-13H2,1,3-5H3/t17-/m0/s1