1-[4-(4-chlorophenyl)-3-nitro-3,4-bis(phenylmethoxy)piperidin-1-yl]ethanone

Systemtic Name: 1-[4-(4-chlorophenyl)-3-nitro-3,4-bis(phenylmethoxy)piperidin-1-yl]ethanone Openeye Name: 1-[3,4-dibenzyloxy-4-(4-chlorophenyl)-3-nitro-1-piperidyl]ethanone CAS Name: 1-[4-(4-chlorophenyl)-3-nitro-3,4-bis(phenylmethoxy)-1-piperidinyl]ethanone IUPAC Name: 1-[4-(4-chlorophenyl)-3-nitro-3,4-bis(phenylmethoxy)piperidin-1-yl]ethanone Traditional Name: 1-[3,4-dibenzoxy-4-(4-chlorophenyl)-3-nitro-piperidino]ethanone Formula: C27H27ClN2O5 MolecularWeight: 494.96668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(C(C1)([N+](=O)[O-])OCC2=CC=CC=C2)(C3=CC=C(C=C3)Cl)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCC(C(C1)([N+](=O)[O-])OCC2=CC=CC=C2)(C3=CC=C(C=C3)Cl)OCC4=CC=CC=C4

InChI

InChI=1S/C27H27ClN2O5/c1-21(31)29-17-16-26(24-12-14-25(28)15-13-24,34-18-22-8-4-2-5-9-22)27(20-29,30(32)33)35-19-23-10-6-3-7-11-23/h2-15H,16-20H2,1H3