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

Systemtic Name: ethyl 2-[4-[[4-(4-cyanophenyl)piperazin-1-yl]methyl]piperidin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[[4-(4-cyanophenyl)piperazin-1-yl]methyl]-1-piperidyl]acetate CAS Name: 2-[4-[[4-(4-cyanophenyl)-1-piperazinyl]methyl]-1-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[[4-(4-cyanophenyl)piperazin-1-yl]methyl]piperidin-1-yl]acetate Traditional Name: 2-[4-[[4-(4-cyanophenyl)piperazino]methyl]piperidino]acetic acid ethyl ester Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCC(CC1)CN2CCN(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC(=O)CN1CCC(CC1)CN2CCN(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H30N4O2/c1-2-27-21(26)17-23-9-7-19(8-10-23)16-24-11-13-25(14-12-24)20-5-3-18(15-22)4-6-20/h3-6,19H,2,7-14,16-17H2,1H3