ethyl 2-[(6R)-6-azido-4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoate

Systemtic Name: ethyl 2-[(6R)-6-azido-4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoate Openeye Name: ethyl 2-[(6R)-6-azido-4-benzyl-1,4-diazepan-1-yl]acetate CAS Name: 2-[(6R)-6-azido-4-(phenylmethyl)-1,4-diazepan-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(6R)-6-azido-4-benzyl-1,4-diazepan-1-yl]acetate Traditional Name: 2-[(6R)-6-azido-4-benzyl-1,4-diazepan-1-yl]acetic acid ethyl ester Formula: C16H23N5O2 MolecularWeight: 317.38612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N5O2/c1-2-23-16(22)13-21-9-8-20(11-15(12-21)18-19-17)10-14-6-4-3-5-7-14/h3-7,15H,2,8-13H2,1H3/t15-/m1/s1