2-phenoxyethyl 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name: 2-phenoxyethyl 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: 2-phenoxyethyl 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid 2-phenoxyethyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCCOC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCCOC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O5/c23-20(27-14-13-26-17-7-3-1-4-8-17)16-9-10-18(19(15-16)22(24)25)21-11-5-2-6-12-21/h1,3-4,7-10,15H,2,5-6,11-14H2