(2E,4E)-1-[3-(imidazol-1-ylmethyl)-4-[(2E,4E)-5-(3,4,5-trimethoxyphenyl)penta-2,4-dienoyl]piperazin-1-yl]-5-(3,4,5-trimethoxyphenyl)penta-2,4-dien-1-one

Systemtic Name: (2E,4E)-1-[3-(imidazol-1-ylmethyl)-4-[(2E,4E)-5-(3,4,5-trimethoxyphenyl)penta-2,4-dienoyl]piperazin-1-yl]-5-(3,4,5-trimethoxyphenyl)penta-2,4-dien-1-one Openeye Name: (2E,4E)-1-[3-(imidazol-1-ylmethyl)-4-[(2E,4E)-5-(3,4,5-trimethoxyphenyl)penta-2,4-dienoyl]piperazin-1-yl]-5-(3,4,5-trimethoxyphenyl)penta-2,4-dien-1-one CAS Name: (2E,4E)-1-[3-(1-imidazolylmethyl)-4-[(2E,4E)-1-oxo-5-(3,4,5-trimethoxyphenyl)penta-2,4-dienyl]-1-piperazinyl]-5-(3,4,5-trimethoxyphenyl)-1-penta-2,4-dienone IUPAC Name: (2E,4E)-1-[3-(imidazol-1-ylmethyl)-4-[(2E,4E)-5-(3,4,5-trimethoxyphenyl)penta-2,4-dienoyl]piperazin-1-yl]-5-(3,4,5-trimethoxyphenyl)penta-2,4-dien-1-one Traditional Name: (2E,4E)-1-[3-(imidazol-1-ylmethyl)-4-[(2E,4E)-5-(3,4,5-trimethoxyphenyl)penta-2,4-dienoyl]piperazino]-5-(3,4,5-trimethoxyphenyl)penta-2,4-dien-1-one Formula: C36H42N4O8 MolecularWeight: 658.74068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC=CC(=O)N2CCN(C(C2)CN3C=CN=C3)C(=O)C=CC=CC4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C=C/C(=O)N2CCN(C(C2)CN3C=CN=C3)C(=O)/C=C/C=C/C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C36H42N4O8/c1-43-29-19-26(20-30(44-2)35(29)47-5)11-7-9-13-33(41)39-17-18-40(28(24-39)23-38-16-15-37-25-38)34(42)14-10-8-12-27-21-31(45-3)36(48-6)32(22-27)46-4/h7-16,19-22,25,28H,17-18,23-24H2,1-6H3/b11-7+,12-8+,13-9+,14-10+