ethyl 4-[[3-(2-hydroxyethyl)-4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]methyl]-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 4-[[3-(2-hydroxyethyl)-4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]methyl]-1H-pyrazole-5-carboxylate Openeye Name: ethyl 4-[[3-(2-hydroxyethyl)-4-(1-isopropyl-4-piperidyl)piperazin-1-yl]methyl]-1H-pyrazole-5-carboxylate CAS Name: 4-[[3-(2-hydroxyethyl)-4-(1-propan-2-yl-4-piperidinyl)-1-piperazinyl]methyl]-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(2-hydroxyethyl)-4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]methyl]-1H-pyrazole-5-carboxylate Traditional Name: 4-[[3-(2-hydroxyethyl)-4-(1-isopropyl-4-piperidyl)piperazino]methyl]-1H-pyrazole-5-carboxylic acid ethyl ester Formula: C21H37N5O3 MolecularWeight: 407.55018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=NN1)CN2CCN(C(C2)CCO)C3CCN(CC3)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(C=NN1)CN2CCN(C(C2)CCO)C3CCN(CC3)C(C)C

InChI

InChI=1S/C21H37N5O3/c1-4-29-21(28)20-17(13-22-23-20)14-24-10-11-26(19(15-24)7-12-27)18-5-8-25(9-6-18)16(2)3/h13,16,18-19,27H,4-12,14-15H2,1-3H3,(H,22,23)