3-piperidin-1-ylpropyl 6-nitro-1,2-benzoxazole-3-carboxylate chloride

Systemtic Name: 3-piperidin-1-ylpropyl 6-nitro-1,2-benzoxazole-3-carboxylate chloride Openeye Name: 3-(1-piperidyl)propyl 6-nitro-1,2-benzoxazole-3-carboxylate chloride CAS Name: 6-nitro-1,2-benzoxazole-3-carboxylic acid 3-(1-piperidinyl)propyl ester chloride IUPAC Name: 3-piperidin-1-ylpropyl 6-nitro-1,2-benzoxazole-3-carboxylate chloride Traditional Name: 6-nitroindoxazene-3-carboxylic acid 3-piperidinopropyl ester chloride Formula: C16H19ClN3O5- MolecularWeight: 368.79216

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC(=O)C2=NOC3=C2C=CC(=C3)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1CCN(CC1)CCCOC(=O)C2=NOC3=C2C=CC(=C3)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C16H19N3O5.ClH/c20-16(23-10-4-9-18-7-2-1-3-8-18)15-13-6-5-12(19(21)22)11-14(13)24-17-15;/h5-6,11H,1-4,7-10H2;1H/p-1