ethyl 2-[4-[2-[(4-cyanophenyl)amino]-5-ethyl-cyclohexa-1,5-dien-1-yl]oxypiperidin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[2-[(4-cyanophenyl)amino]-5-ethyl-cyclohexa-1,5-dien-1-yl]oxypiperidin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[2-(4-cyanoanilino)-5-ethyl-cyclohexa-1,5-dien-1-yl]oxy-1-piperidyl]acetate CAS Name: 2-[4-[[2-(4-cyanoanilino)-5-ethyl-1-cyclohexa-1,5-dienyl]oxy]-1-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[2-(4-cyanoanilino)-5-ethylcyclohexa-1,5-dien-1-yl]oxypiperidin-1-yl]acetate Traditional Name: 2-[4-[2-(4-cyanoanilino)-5-ethyl-cyclohexa-1,5-dien-1-yl]oxypiperidino]acetic acid ethyl ester Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(CC1)NC2=CC=C(C=C2)C#N)OC3CCN(CC3)CC(=O)OCC

Isomeric SMILES

CCC1=CC(=C(CC1)NC2=CC=C(C=C2)C#N)OC3CCN(CC3)CC(=O)OCC

InChI

InChI=1S/C24H31N3O3/c1-3-18-7-10-22(26-20-8-5-19(16-25)6-9-20)23(15-18)30-21-11-13-27(14-12-21)17-24(28)29-4-2/h5-6,8-9,15,21,26H,3-4,7,10-14,17H2,1-2H3