3-[4-(3-nitrooxypropyl)piperazin-1-yl]propyl 5-(phenylcarbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: 3-[4-(3-nitrooxypropyl)piperazin-1-yl]propyl 5-(phenylcarbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: 3-[4-(3-nitrooxypropyl)piperazin-1-yl]propyl 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid 3-[4-(3-nitrooxypropyl)-1-piperazinyl]propyl ester IUPAC Name: 3-[4-(3-nitrooxypropyl)piperazin-1-yl]propyl 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid 3-[4-(3-nitrooxypropyl)piperazino]propyl ester Formula: C25H32N4O6 MolecularWeight: 484.54478

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)OCCCN4CCN(CC4)CCCO[N+](=O)[O-]

Isomeric SMILES

C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)OCCCN4CCN(CC4)CCCO[N+](=O)[O-]

InChI

InChI=1S/C25H32N4O6/c30-24(20-6-2-1-3-7-20)23-9-8-22-21(10-13-28(22)23)25(31)34-18-4-11-26-14-16-27(17-15-26)12-5-19-35-29(32)33/h1-3,6-9,21H,4-5,10-19H2