ethyl 1-[5-[[4-(phenylmethyl)piperazin-1-yl]methyl]furan-2-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-[[4-(phenylmethyl)piperazin-1-yl]methyl]furan-2-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-[(4-benzylpiperazin-1-yl)methyl]furan-2-carbonyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[5-[[4-(phenylmethyl)-1-piperazinyl]methyl]-2-furanyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-[(4-benzylpiperazin-1-yl)methyl]furan-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[5-[(4-benzylpiperazino)methyl]-2-furoyl]isonipecotic acid ethyl ester Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(O2)CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(O2)CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O4/c1-2-31-25(30)21-10-12-28(13-11-21)24(29)23-9-8-22(32-23)19-27-16-14-26(15-17-27)18-20-6-4-3-5-7-20/h3-9,21H,2,10-19H2,1H3