[2-methyl-4-[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]piperazin-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [2-methyl-4-[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]piperazin-1-yl]-(4-nitrophenyl)methanone Openeye Name: [2-methyl-4-[2-(3,4,5-trimethoxyphenyl)-4-pyridyl]piperazin-1-yl]-(4-nitrophenyl)methanone CAS Name: [2-methyl-4-[2-(3,4,5-trimethoxyphenyl)-4-pyridinyl]-1-piperazinyl]-(4-nitrophenyl)methanone IUPAC Name: [2-methyl-4-[2-(3,4,5-trimethoxyphenyl)pyridin-4-yl]piperazin-1-yl]-(4-nitrophenyl)methanone Traditional Name: [2-methyl-4-[2-(3,4,5-trimethoxyphenyl)-4-pyridyl]piperazino]-(4-nitrophenyl)methanone Formula: C26H28N4O6 MolecularWeight: 492.52372

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=NC=C3)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=NC=C3)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C26H28N4O6/c1-17-16-28(11-12-29(17)26(31)18-5-7-20(8-6-18)30(32)33)21-9-10-27-22(15-21)19-13-23(34-2)25(36-4)24(14-19)35-3/h5-10,13-15,17H,11-12,16H2,1-4H3