(phenylmethyl) 4-oxidanylidene-4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butanoate

Systemtic Name: (phenylmethyl) 4-oxidanylidene-4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butanoate Openeye Name: benzyl 4-oxo-4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butanoate CAS Name: 4-oxo-4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-oxo-4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butanoate Traditional Name: 4-keto-4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butyric acid benzyl ester Formula: C21H31NO7 MolecularWeight: 409.47334

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOCCOCCOCCN1C(=O)CCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1COCCOCCOCCOCCN1C(=O)CCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H31NO7/c23-20(6-7-21(24)29-18-19-4-2-1-3-5-19)22-8-10-25-12-14-27-16-17-28-15-13-26-11-9-22/h1-5H,6-18H2