2-thiophen-3-ylethyl 4-[(2-phenylmethoxyphenyl)methyl]piperazine-1-carboxylate

Systemtic Name: 2-thiophen-3-ylethyl 4-[(2-phenylmethoxyphenyl)methyl]piperazine-1-carboxylate Openeye Name: 2-(3-thienyl)ethyl 4-[(2-benzyloxyphenyl)methyl]piperazine-1-carboxylate CAS Name: 4-[(2-phenylmethoxyphenyl)methyl]-1-piperazinecarboxylic acid 2-(3-thiophenyl)ethyl ester IUPAC Name: 2-thiophen-3-ylethyl 4-[(2-phenylmethoxyphenyl)methyl]piperazine-1-carboxylate Traditional Name: 4-(2-benzoxybenzyl)piperazine-1-carboxylic acid 2-(3-thienyl)ethyl ester Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2OCC3=CC=CC=C3)C(=O)OCCC4=CSC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2OCC3=CC=CC=C3)C(=O)OCCC4=CSC=C4

InChI

InChI=1S/C25H28N2O3S/c28-25(29-16-10-22-11-17-31-20-22)27-14-12-26(13-15-27)18-23-8-4-5-9-24(23)30-19-21-6-2-1-3-7-21/h1-9,11,17,20H,10,12-16,18-19H2