ethyl 2-[1-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]piperidin-2-yl]ethanoate

Systemtic Name: ethyl 2-[1-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]piperidin-2-yl]ethanoate Openeye Name: ethyl 2-[1-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-2-piperidyl]acetate CAS Name: 2-[1-[[2-methylsulfonyl-3-(3-phenylpropyl)-4-imidazolyl]methyl]-2-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]piperidin-2-yl]acetate Traditional Name: 2-[1-[[2-mesyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-2-piperidyl]acetic acid ethyl ester Formula: C23H33N3O4S MolecularWeight: 447.59082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCCCN1CC2=CN=C(N2CCCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)CC1CCCCN1CC2=CN=C(N2CCCC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H33N3O4S/c1-3-30-22(27)16-20-13-7-8-14-25(20)18-21-17-24-23(31(2,28)29)26(21)15-9-12-19-10-5-4-6-11-19/h4-6,10-11,17,20H,3,7-9,12-16,18H2,1-2H3