N-(2-methoxy-5-nitro-phenyl)-1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]piperidin-4-amine

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]piperidin-4-amine Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N-(2-methoxy-5-nitro-phenyl)piperidin-4-amine CAS Name: N-(2-methoxy-5-nitrophenyl)-1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-piperidinamine IUPAC Name: N-(2-methoxy-5-nitrophenyl)-1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]piperidin-4-amine Traditional Name: [1-(4-benzoxy-3-methoxy-benzyl)-4-piperidyl]-(2-methoxy-5-nitro-phenyl)amine Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2CCN(CC2)CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2CCN(CC2)CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C27H31N3O5/c1-33-25-11-9-23(30(31)32)17-24(25)28-22-12-14-29(15-13-22)18-21-8-10-26(27(16-21)34-2)35-19-20-6-4-3-5-7-20/h3-11,16-17,22,28H,12-15,18-19H2,1-2H3