ethyl 3-[4-[2-[(4-nitrophenyl)-phenyl-methoxy]ethyl]piperazin-1-yl]propanoate

Systemtic Name: ethyl 3-[4-[2-[(4-nitrophenyl)-phenyl-methoxy]ethyl]piperazin-1-yl]propanoate Openeye Name: ethyl 3-[4-[2-[(4-nitrophenyl)-phenyl-methoxy]ethyl]piperazin-1-yl]propanoate CAS Name: 3-[4-[2-[(4-nitrophenyl)-phenylmethoxy]ethyl]-1-piperazinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[2-[(4-nitrophenyl)-phenylmethoxy]ethyl]piperazin-1-yl]propanoate Traditional Name: 3-[4-[2-[(4-nitrophenyl)-phenyl-methoxy]ethyl]piperazino]propionic acid ethyl ester Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1CCN(CC1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCN1CCN(CC1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H31N3O5/c1-2-31-23(28)12-13-25-14-16-26(17-15-25)18-19-32-24(20-6-4-3-5-7-20)21-8-10-22(11-9-21)27(29)30/h3-11,24H,2,12-19H2,1H3