3-[4-(3-nitrooxypropyl)piperidin-1-yl]propyl 4-sulfamoylbenzoate

Systemtic Name: 3-[4-(3-nitrooxypropyl)piperidin-1-yl]propyl 4-sulfamoylbenzoate Openeye Name: 3-[4-(3-nitrooxypropyl)-1-piperidyl]propyl 4-sulfamoylbenzoate CAS Name: 4-sulfamoylbenzoic acid 3-[4-(3-nitrooxypropyl)-1-piperidinyl]propyl ester IUPAC Name: 3-[4-(3-nitrooxypropyl)piperidin-1-yl]propyl 4-sulfamoylbenzoate Traditional Name: 4-sulfamoylbenzoic acid 3-[4-(3-nitrooxypropyl)piperidino]propyl ester Formula: C18H27N3O7S MolecularWeight: 429.48788

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCCO[N+](=O)[O-])CCCOC(=O)C2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

C1CN(CCC1CCCO[N+](=O)[O-])CCCOC(=O)C2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C18H27N3O7S/c19-29(25,26)17-6-4-16(5-7-17)18(22)27-13-2-10-20-11-8-15(9-12-20)3-1-14-28-21(23)24/h4-7,15H,1-3,8-14H2,(H2,19,25,26)