[2-(piperidin-1-ylmethyl)naphthalen-1-yl] 4-nitrobenzoate

Systemtic Name: [2-(piperidin-1-ylmethyl)naphthalen-1-yl] 4-nitrobenzoate Openeye Name: [2-(1-piperidylmethyl)-1-naphthyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(1-piperidinylmethyl)-1-naphthalenyl] ester IUPAC Name: [2-(piperidin-1-ylmethyl)naphthalen-1-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-(piperidinomethyl)-1-naphthyl] ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C(C3=CC=CC=C3C=C2)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=C(C3=CC=CC=C3C=C2)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N2O4/c26-23(18-10-12-20(13-11-18)25(27)28)29-22-19(16-24-14-4-1-5-15-24)9-8-17-6-2-3-7-21(17)22/h2-3,6-13H,1,4-5,14-16H2