methyl 4-[4-(2-hexylphenyl)phenoxy]-5-oxidanylidene-pyrrolidine-2-carboxylate

Systemtic Name: methyl 4-[4-(2-hexylphenyl)phenoxy]-5-oxidanylidene-pyrrolidine-2-carboxylate Openeye Name: methyl 4-[4-(2-hexylphenyl)phenoxy]-5-oxo-pyrrolidine-2-carboxylate CAS Name: 4-[4-(2-hexylphenyl)phenoxy]-5-oxo-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-(2-hexylphenyl)phenoxy]-5-oxopyrrolidine-2-carboxylate Traditional Name: 4-[4-(2-hexylphenyl)phenoxy]-5-keto-pyrrolidine-2-carboxylic acid methyl ester Formula: C24H29NO4 MolecularWeight: 395.49136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=CC=C1C2=CC=C(C=C2)OC3CC(NC3=O)C(=O)OC

Isomeric SMILES

CCCCCCC1=CC=CC=C1C2=CC=C(C=C2)OC3CC(NC3=O)C(=O)OC

InChI

InChI=1S/C24H29NO4/c1-3-4-5-6-9-17-10-7-8-11-20(17)18-12-14-19(15-13-18)29-22-16-21(24(27)28-2)25-23(22)26/h7-8,10-15,21-22H,3-6,9,16H2,1-2H3,(H,25,26)