[4-ethoxy-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]pyrimidin-5-yl] methanoate

Systemtic Name: [4-ethoxy-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]pyrimidin-5-yl] methanoate Openeye Name: [4-ethoxy-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]pyrimidin-5-yl] formate CAS Name: formic acid [4-ethoxy-2-[4-(3,3,3-triphenylpropyl)-1-piperazinyl]-5-pyrimidinyl] ester IUPAC Name: [4-ethoxy-2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]pyrimidin-5-yl] formate Traditional Name: formic acid [4-ethoxy-2-[4-(3,3,3-triphenylpropyl)piperazino]pyrimidin-5-yl] ester Formula: C32H34N4O3 MolecularWeight: 522.63736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC=C1OC=O)N2CCN(CC2)CCC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=NC(=NC=C1OC=O)N2CCN(CC2)CCC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H34N4O3/c1-2-38-30-29(39-25-37)24-33-31(34-30)36-22-20-35(21-23-36)19-18-32(26-12-6-3-7-13-26,27-14-8-4-9-15-27)28-16-10-5-11-17-28/h3-17,24-25H,2,18-23H2,1H3