propan-2-yl 3-[[4-[1-(4-chlorophenyl)-2-ethoxy-2-oxidanylidene-ethyl]piperazin-1-yl]carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-[[4-[1-(4-chlorophenyl)-2-ethoxy-2-oxidanylidene-ethyl]piperazin-1-yl]carbonylamino]propanoate Openeye Name: isopropyl 3-[[4-[1-(4-chlorophenyl)-2-ethoxy-2-oxo-ethyl]piperazine-1-carbonyl]amino]propanoate CAS Name: 3-[[[4-[1-(4-chlorophenyl)-2-ethoxy-2-oxoethyl]-1-piperazinyl]-oxomethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[4-[1-(4-chlorophenyl)-2-ethoxy-2-oxoethyl]piperazine-1-carbonyl]amino]propanoate Traditional Name: 3-[[4-[1-(4-chlorophenyl)-2-ethoxy-2-keto-ethyl]piperazine-1-carbonyl]amino]propionic acid isopropyl ester Formula: C21H30ClN3O5 MolecularWeight: 439.933

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)NCCC(=O)OC(C)C

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)NCCC(=O)OC(C)C

InChI

InChI=1S/C21H30ClN3O5/c1-4-29-20(27)19(16-5-7-17(22)8-6-16)24-11-13-25(14-12-24)21(28)23-10-9-18(26)30-15(2)3/h5-8,15,19H,4,9-14H2,1-3H3,(H,23,28)