3-(2-methylpiperidin-1-yl)propyl 6-nitro-1,2-benzoxazole-3-carboxylate

Systemtic Name: 3-(2-methylpiperidin-1-yl)propyl 6-nitro-1,2-benzoxazole-3-carboxylate Openeye Name: 3-(2-methyl-1-piperidyl)propyl 6-nitro-1,2-benzoxazole-3-carboxylate CAS Name: 6-nitro-1,2-benzoxazole-3-carboxylic acid 3-(2-methyl-1-piperidinyl)propyl ester IUPAC Name: 3-(2-methylpiperidin-1-yl)propyl 6-nitro-1,2-benzoxazole-3-carboxylate Traditional Name: 6-nitroindoxazene-3-carboxylic acid 3-(2-methylpiperidino)propyl ester Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCOC(=O)C2=NOC3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1CCCOC(=O)C2=NOC3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O5/c1-12-5-2-3-8-19(12)9-4-10-24-17(21)16-14-7-6-13(20(22)23)11-15(14)25-18-16/h6-7,11-12H,2-5,8-10H2,1H3