ethyl 2-[3-oxidanylidene-1-[6-(phenylmethoxycarbonylamino)hexanoyl]piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[3-oxidanylidene-1-[6-(phenylmethoxycarbonylamino)hexanoyl]piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[1-[6-(benzyloxycarbonylamino)hexanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[1-oxo-6-(phenylmethoxycarbonylamino)hexyl]-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-oxo-1-[6-(phenylmethoxycarbonylamino)hexanoyl]piperazin-2-yl]acetate Traditional Name: 2-[1-[6-(benzyloxycarbonylamino)hexanoyl]-3-keto-piperazin-2-yl]acetic acid ethyl ester Formula: C22H31N3O6 MolecularWeight: 433.49804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)NCCN1C(=O)CCCCCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC1C(=O)NCCN1C(=O)CCCCCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H31N3O6/c1-2-30-20(27)15-18-21(28)23-13-14-25(18)19(26)11-7-4-8-12-24-22(29)31-16-17-9-5-3-6-10-17/h3,5-6,9-10,18H,2,4,7-8,11-16H2,1H3,(H,23,28)(H,24,29)