4-nitrooxybutyl 4-phenylbenzoate

Systemtic Name: 4-nitrooxybutyl 4-phenylbenzoate Openeye Name: 4-nitrooxybutyl 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid 4-nitrooxybutyl ester IUPAC Name: 4-nitrooxybutyl 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid 4-nitrooxybutyl ester Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCCCCO[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCCCCO[N+](=O)[O-]

InChI

InChI=1S/C17H17NO5/c19-17(22-12-4-5-13-23-18(20)21)16-10-8-15(9-11-16)14-6-2-1-3-7-14/h1-3,6-11H,4-5,12-13H2