(phenylmethyl) 6-oxidanylidene-6-(1,4,7-trioxa-10-azacyclododec-10-yl)hexanoate

Systemtic Name: (phenylmethyl) 6-oxidanylidene-6-(1,4,7-trioxa-10-azacyclododec-10-yl)hexanoate Openeye Name: benzyl 6-oxo-6-(1,4,7-trioxa-10-azacyclododec-10-yl)hexanoate CAS Name: 6-oxo-6-(1,4,7-trioxa-10-azacyclododec-10-yl)hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-oxo-6-(1,4,7-trioxa-10-azacyclododec-10-yl)hexanoate Traditional Name: 6-keto-6-(1,4,7-trioxa-10-azacyclododec-10-yl)hexanoic acid benzyl ester Formula: C21H31NO6 MolecularWeight: 393.47394

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOCCOCCN1C(=O)CCCCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1COCCOCCOCCN1C(=O)CCCCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H31NO6/c23-20(22-10-12-25-14-16-27-17-15-26-13-11-22)8-4-5-9-21(24)28-18-19-6-2-1-3-7-19/h1-3,6-7H,4-5,8-18H2