ethyl 2-[4-(4-cyanophenyl)-1-(2-ethoxy-2-oxidanylidene-ethyl)-4-piperazin-1-yl-piperidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[4-(4-cyanophenyl)-1-(2-ethoxy-2-oxidanylidene-ethyl)-4-piperazin-1-yl-piperidin-3-yl]ethanoate Openeye Name: ethyl 2-[4-(4-cyanophenyl)-1-(2-ethoxy-2-oxo-ethyl)-4-piperazin-1-yl-3-piperidyl]acetate CAS Name: 2-[4-(4-cyanophenyl)-1-(2-ethoxy-2-oxoethyl)-4-(1-piperazinyl)-3-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-cyanophenyl)-1-(2-ethoxy-2-oxoethyl)-4-piperazin-1-ylpiperidin-3-yl]acetate Traditional Name: 2-[4-(4-cyanophenyl)-1-(2-ethoxy-2-keto-ethyl)-4-piperazino-3-piperidyl]acetic acid ethyl ester Formula: C24H34N4O4 MolecularWeight: 442.55116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CN(CCC1(C2=CC=C(C=C2)C#N)N3CCNCC3)CC(=O)OCC

Isomeric SMILES

CCOC(=O)CC1CN(CCC1(C2=CC=C(C=C2)C#N)N3CCNCC3)CC(=O)OCC

InChI

InChI=1S/C24H34N4O4/c1-3-31-22(29)15-21-17-27(18-23(30)32-4-2)12-9-24(21,28-13-10-26-11-14-28)20-7-5-19(16-25)6-8-20/h5-8,21,26H,3-4,9-15,17-18H2,1-2H3