2-[(2,6-diazidopurin-9-yl)methoxy]ethyl benzoate

Systemtic Name: 2-[(2,6-diazidopurin-9-yl)methoxy]ethyl benzoate Openeye Name: 2-[(2,6-diazidopurin-9-yl)methoxy]ethyl benzoate CAS Name: benzoic acid 2-[(2,6-diazido-9-purinyl)methoxy]ethyl ester IUPAC Name: 2-[(2,6-diazidopurin-9-yl)methoxy]ethyl benzoate Traditional Name: benzoic acid 2-[(2,6-diazidopurin-9-yl)methoxy]ethyl ester Formula: C15H12N10O3 MolecularWeight: 380.32098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCOCN2C=NC3=C(N=C(N=C32)N=[N+]=[N-])N=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCOCN2C=NC3=C(N=C(N=C32)N=[N+]=[N-])N=[N+]=[N-]

InChI

InChI=1S/C15H12N10O3/c16-23-21-12-11-13(20-15(19-12)22-24-17)25(8-18-11)9-27-6-7-28-14(26)10-4-2-1-3-5-10/h1-5,8H,6-7,9H2