[4-[4-[6-(3,4-dimethoxyphenyl)pyridin-2-yl]carbonylpiperazin-1-yl]phenoxy]-pyridin-4-yl-methanolate

Systemtic Name: [4-[4-[6-(3,4-dimethoxyphenyl)pyridin-2-yl]carbonylpiperazin-1-yl]phenoxy]-pyridin-4-yl-methanolate Openeye Name: [4-[4-[6-(3,4-dimethoxyphenyl)pyridine-2-carbonyl]piperazin-1-yl]phenoxy]-(4-pyridyl)methanolate CAS Name: [4-[4-[[6-(3,4-dimethoxyphenyl)-2-pyridinyl]-oxomethyl]-1-piperazinyl]phenoxy]-pyridin-4-ylmethanolate IUPAC Name: [4-[4-[6-(3,4-dimethoxyphenyl)pyridine-2-carbonyl]piperazin-1-yl]phenoxy]-pyridin-4-ylmethanolate Traditional Name: [4-[4-[6-(3,4-dimethoxyphenyl)picolinoyl]piperazino]phenoxy]-(4-pyridyl)methanolate Formula: C30H29N4O5- MolecularWeight: 525.57506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CC=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)OC(C5=CC=NC=C5)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CC=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)OC(C5=CC=NC=C5)[O-])OC

InChI

InChI=1S/C30H29N4O5/c1-37-27-11-6-22(20-28(27)38-2)25-4-3-5-26(32-25)29(35)34-18-16-33(17-19-34)23-7-9-24(10-8-23)39-30(36)21-12-14-31-15-13-21/h3-15,20,30H,16-19H2,1-2H3/q-1