2-piperidin-2-ylethyl 3-nitrobenzoate

Systemtic Name: 2-piperidin-2-ylethyl 3-nitrobenzoate Openeye Name: 2-(2-piperidyl)ethyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid 2-(2-piperidinyl)ethyl ester IUPAC Name: 2-piperidin-2-ylethyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid 2-(2-piperidyl)ethyl ester Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)CCOC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCNC(C1)CCOC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O4/c17-14(11-4-3-6-13(10-11)16(18)19)20-9-7-12-5-1-2-8-15-12/h3-4,6,10,12,15H,1-2,5,7-9H2