4-nitrooxybutyl 5-(phenylcarbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: 4-nitrooxybutyl 5-(phenylcarbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: 4-nitrooxybutyl 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid 4-nitrooxybutyl ester IUPAC Name: 4-nitrooxybutyl 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid 4-nitrooxybutyl ester Formula: C19H20N2O6 MolecularWeight: 372.3719

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)OCCCCO[N+](=O)[O-]

Isomeric SMILES

C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)OCCCCO[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O6/c22-18(14-6-2-1-3-7-14)17-9-8-16-15(10-11-20(16)17)19(23)26-12-4-5-13-27-21(24)25/h1-3,6-9,15H,4-5,10-13H2