ethyl 2,6-diethoxy-4-[[4-(pyridin-3-ylamino)piperidin-1-yl]methyl]benzoate

Systemtic Name: ethyl 2,6-diethoxy-4-[[4-(pyridin-3-ylamino)piperidin-1-yl]methyl]benzoate Openeye Name: ethyl 2,6-diethoxy-4-[[4-(3-pyridylamino)-1-piperidyl]methyl]benzoate CAS Name: 2,6-diethoxy-4-[[4-(3-pyridinylamino)-1-piperidinyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 2,6-diethoxy-4-[[4-(pyridin-3-ylamino)piperidin-1-yl]methyl]benzoate Traditional Name: 2,6-diethoxy-4-[[4-(3-pyridylamino)piperidino]methyl]benzoic acid ethyl ester Formula: C24H33N3O4 MolecularWeight: 427.53652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C(=O)OCC)OCC)CN2CCC(CC2)NC3=CN=CC=C3

Isomeric SMILES

CCOC1=CC(=CC(=C1C(=O)OCC)OCC)CN2CCC(CC2)NC3=CN=CC=C3

InChI

InChI=1S/C24H33N3O4/c1-4-29-21-14-18(15-22(30-5-2)23(21)24(28)31-6-3)17-27-12-9-19(10-13-27)26-20-8-7-11-25-16-20/h7-8,11,14-16,19,26H,4-6,9-10,12-13,17H2,1-3H3