methyl 4-[[1-(4-hexylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoate

Systemtic Name: methyl 4-[[1-(4-hexylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoate Openeye Name: methyl 4-[[1-(4-hexylphenyl)-5-oxo-pyrrolidin-3-yl]methoxy]benzoate CAS Name: 4-[[1-(4-hexylphenyl)-5-oxo-3-pyrrolidinyl]methoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(4-hexylphenyl)-5-oxopyrrolidin-3-yl]methoxy]benzoate Traditional Name: 4-[[1-(4-hexylphenyl)-5-keto-pyrrolidin-3-yl]methoxy]benzoic acid methyl ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C25H31NO4/c1-3-4-5-6-7-19-8-12-22(13-9-19)26-17-20(16-24(26)27)18-30-23-14-10-21(11-15-23)25(28)29-2/h8-15,20H,3-7,16-18H2,1-2H3