ethyl 4-[(3R)-3-(2-hydroxyphenyl)-3-(3-hydroxyphenyl)propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(3R)-3-(2-hydroxyphenyl)-3-(3-hydroxyphenyl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(3R)-3-(2-hydroxyphenyl)-3-(3-hydroxyphenyl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[(3R)-3-(2-hydroxyphenyl)-3-(3-hydroxyphenyl)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3R)-3-(2-hydroxyphenyl)-3-(3-hydroxyphenyl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[(3R)-3-(2-hydroxyphenyl)-3-(3-hydroxyphenyl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CC(C2=CC(=CC=C2)O)C3=CC=CC=C3O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C[C@H](C2=CC(=CC=C2)O)C3=CC=CC=C3O

InChI

InChI=1S/C22H26N2O5/c1-2-29-22(28)24-12-10-23(11-13-24)21(27)15-19(16-6-5-7-17(25)14-16)18-8-3-4-9-20(18)26/h3-9,14,19,25-26H,2,10-13,15H2,1H3/t19-/m1/s1