phenacyl 1-[4-(3,4-dimethylphenoxy)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: phenacyl 1-[4-(3,4-dimethylphenoxy)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: phenacyl 1-[4-(3,4-dimethylphenoxy)phenyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-[4-(3,4-dimethylphenoxy)phenyl]-5-oxo-3-pyrrolidinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 1-[4-(3,4-dimethylphenoxy)phenyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-[4-(3,4-dimethylphenoxy)phenyl]-5-keto-pyrrolidine-3-carboxylic acid phenacyl ester Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=CC=C(C=C2)N3CC(CC3=O)C(=O)OCC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=CC=C(C=C2)N3CC(CC3=O)C(=O)OCC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H25NO5/c1-18-8-11-24(14-19(18)2)33-23-12-9-22(10-13-23)28-16-21(15-26(28)30)27(31)32-17-25(29)20-6-4-3-5-7-20/h3-14,21H,15-17H2,1-2H3