ethyl 4-[(4-ethoxycarbonylpiperazin-1-yl)-phenyl-phosphoryl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(4-ethoxycarbonylpiperazin-1-yl)-phenyl-phosphoryl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(4-ethoxycarbonylpiperazin-1-yl)-phenyl-phosphoryl]piperazine-1-carboxylate CAS Name: 4-[(4-ethoxycarbonyl-1-piperazinyl)-phenylphosphoryl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethoxycarbonylpiperazin-1-yl)-phenylphosphoryl]piperazine-1-carboxylate Traditional Name: 4-[(4-carbethoxypiperazino)-phenyl-phosphoryl]piperazine-1-carboxylic acid ethyl ester Formula: C20H31N4O5P MolecularWeight: 438.457701

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)P(=O)(C2=CC=CC=C2)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)P(=O)(C2=CC=CC=C2)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C20H31N4O5P/c1-3-28-19(25)21-10-14-23(15-11-21)30(27,18-8-6-5-7-9-18)24-16-12-22(13-17-24)20(26)29-4-2/h5-9H,3-4,10-17H2,1-2H3