4-oxidanylbutyl 4-(2-nitrophenyl)benzoate

Systemtic Name: 4-oxidanylbutyl 4-(2-nitrophenyl)benzoate Openeye Name: 4-hydroxybutyl 4-(2-nitrophenyl)benzoate CAS Name: 4-(2-nitrophenyl)benzoic acid 4-hydroxybutyl ester IUPAC Name: 4-hydroxybutyl 4-(2-nitrophenyl)benzoate Traditional Name: 4-(2-nitrophenyl)benzoic acid 4-hydroxybutyl 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/c19-11-3-4-12-23-17(20)14-9-7-13(8-10-14)15-5-1-2-6-16(15)18(21)22/h1-2,5-10,19H,3-4,11-12H2