2-[4-(azidomethyl)phenyl]pentanoic acid

Systemtic Name: 2-[4-(azidomethyl)phenyl]pentanoic acid Openeye Name: 2-[4-(azidomethyl)phenyl]pentanoic acid CAS Name: 2-[4-(azidomethyl)phenyl]pentanoic acid IUPAC Name: 2-[4-(azidomethyl)phenyl]pentanoic acid Traditional Name: 2-[4-(azidomethyl)phenyl]valeric acid Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)CN=[N+]=[N-])C(=O)O

Isomeric SMILES

CCCC(C1=CC=C(C=C1)CN=[N+]=[N-])C(=O)O

InChI

InChI=1S/C12H15N3O2/c1-2-3-11(12(16)17)10-6-4-9(5-7-10)8-14-15-13/h4-7,11H,2-3,8H2,1H3,(H,16,17)