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

Systemtic Name: ethyl 2-[4-(4-cyanophenyl)-3-oxidanylidene-4-piperazin-1-yl-piperidin-1-yl]ethanoate Openeye Name: ethyl 2-[4-(4-cyanophenyl)-3-oxo-4-piperazin-1-yl-1-piperidyl]acetate CAS Name: 2-[4-(4-cyanophenyl)-3-oxo-4-(1-piperazinyl)-1-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-cyanophenyl)-3-oxo-4-piperazin-1-ylpiperidin-1-yl]acetate Traditional Name: 2-[4-(4-cyanophenyl)-3-keto-4-piperazino-piperidino]acetic acid ethyl ester Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCC(C(=O)C1)(C2=CC=C(C=C2)C#N)N3CCNCC3

Isomeric SMILES

CCOC(=O)CN1CCC(C(=O)C1)(C2=CC=C(C=C2)C#N)N3CCNCC3

InChI

InChI=1S/C20H26N4O3/c1-2-27-19(26)15-23-10-7-20(18(25)14-23,24-11-8-22-9-12-24)17-5-3-16(13-21)4-6-17/h3-6,22H,2,7-12,14-15H2,1H3