1-[2-(3-nitro-4-phenylmethoxy-phenoxy)ethyl]-4-(phenylmethyl)piperidine

Systemtic Name: 1-[2-(3-nitro-4-phenylmethoxy-phenoxy)ethyl]-4-(phenylmethyl)piperidine Openeye Name: 4-benzyl-1-[2-(4-benzyloxy-3-nitro-phenoxy)ethyl]piperidine CAS Name: 1-[2-(3-nitro-4-phenylmethoxyphenoxy)ethyl]-4-(phenylmethyl)piperidine IUPAC Name: 4-benzyl-1-[2-(3-nitro-4-phenylmethoxyphenoxy)ethyl]piperidine Traditional Name: 1-[2-(4-benzoxy-3-nitro-phenoxy)ethyl]-4-benzyl-piperidine Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCOC3=CC(=C(C=C3)OCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCOC3=CC(=C(C=C3)OCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H30N2O4/c30-29(31)26-20-25(11-12-27(26)33-21-24-9-5-2-6-10-24)32-18-17-28-15-13-23(14-16-28)19-22-7-3-1-4-8-22/h1-12,20,23H,13-19,21H2