1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-4-(4-nitrophenyl)piperazine

Systemtic Name: 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-4-(4-nitrophenyl)piperazine Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)methyl]-4-(4-nitrophenyl)piperazine CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-(4-nitrophenyl)piperazine IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-(4-nitrophenyl)piperazine Traditional Name: 1-(4-benzoxy-3-methoxy-benzyl)-4-(4-nitrophenyl)piperazine Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OCC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O4/c1-31-25-17-21(7-12-24(25)32-19-20-5-3-2-4-6-20)18-26-13-15-27(16-14-26)22-8-10-23(11-9-22)28(29)30/h2-12,17H,13-16,18-19H2,1H3