phenyl 2-[3-oxidanylidene-3-[(2R)-2-(phenylmethyl)piperazin-1-yl]propyl]benzoate

Systemtic Name: phenyl 2-[3-oxidanylidene-3-[(2R)-2-(phenylmethyl)piperazin-1-yl]propyl]benzoate Openeye Name: phenyl 2-[3-[(2R)-2-benzylpiperazin-1-yl]-3-oxo-propyl]benzoate CAS Name: 2-[3-oxo-3-[(2R)-2-(phenylmethyl)-1-piperazinyl]propyl]benzoic acid phenyl ester IUPAC Name: phenyl 2-[3-[(2R)-2-benzylpiperazin-1-yl]-3-oxopropyl]benzoate Traditional Name: 2-[3-[(2R)-2-benzylpiperazino]-3-keto-propyl]benzoic acid phenyl ester Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)CC2=CC=CC=C2)C(=O)CCC3=CC=CC=C3C(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CN([C@@H](CN1)CC2=CC=CC=C2)C(=O)CCC3=CC=CC=C3C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O3/c30-26(29-18-17-28-20-23(29)19-21-9-3-1-4-10-21)16-15-22-11-7-8-14-25(22)27(31)32-24-12-5-2-6-13-24/h1-14,23,28H,15-20H2/t23-/m1/s1