1-[(1Z,3E)-2,4-bis(3-methoxy-2-nitro-phenyl)buta-1,3-dienyl]pyrrolidine

Systemtic Name: 1-[(1Z,3E)-2,4-bis(3-methoxy-2-nitro-phenyl)buta-1,3-dienyl]pyrrolidine Openeye Name: 1-[(1Z,3E)-2,4-bis(3-methoxy-2-nitro-phenyl)buta-1,3-dienyl]pyrrolidine CAS Name: 1-[(1Z,3E)-2,4-bis(3-methoxy-2-nitrophenyl)buta-1,3-dienyl]pyrrolidine IUPAC Name: 1-[(1Z,3E)-2,4-bis(3-methoxy-2-nitrophenyl)buta-1,3-dienyl]pyrrolidine Traditional Name: 1-[(1Z,3E)-2,4-bis(3-methoxy-2-nitro-phenyl)buta-1,3-dienyl]pyrrolidine Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1[N+](=O)[O-])C=CC(=CN2CCCC2)C3=C(C(=CC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1[N+](=O)[O-])/C=C/C(=C/N2CCCC2)/C3=C(C(=CC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O6/c1-30-19-9-5-7-16(21(19)24(26)27)11-12-17(15-23-13-3-4-14-23)18-8-6-10-20(31-2)22(18)25(28)29/h5-12,15H,3-4,13-14H2,1-2H3/b12-11+,17-15-