ethyl 2-[(3R)-3-(azidomethyl)-4-(phenylmethyl)piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[(3R)-3-(azidomethyl)-4-(phenylmethyl)piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[(3R)-3-(azidomethyl)-4-benzyl-piperazin-1-yl]acetate CAS Name: 2-[(3R)-3-(azidomethyl)-4-(phenylmethyl)-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3R)-3-(azidomethyl)-4-benzylpiperazin-1-yl]acetate Traditional Name: 2-[(3R)-3-(azidomethyl)-4-benzyl-piperazino]acetic acid ethyl ester Formula: C16H23N5O2 MolecularWeight: 317.38612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(C(C1)CN=[N+]=[N-])CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CN1CCN([C@H](C1)CN=[N+]=[N-])CC2=CC=CC=C2

InChI

InChI=1S/C16H23N5O2/c1-2-23-16(22)13-20-8-9-21(15(12-20)10-18-19-17)11-14-6-4-3-5-7-14/h3-7,15H,2,8-13H2,1H3/t15-/m0/s1