6-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]hexyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate

Systemtic Name: 6-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]hexyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Openeye Name: 6-[4-[3-(2-methylpropanoylamino)phenyl]-1-piperidyl]hexyl 5-methyl-3-phenyl-isoxazole-4-carboxylate CAS Name: 5-methyl-3-phenyl-4-isoxazolecarboxylic acid 6-[4-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-1-piperidinyl]hexyl ester IUPAC Name: 6-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]hexyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-phenyl-isoxazole-4-carboxylic acid 6-[4-[3-(isobutyrylamino)phenyl]piperidino]hexyl ester Formula: C32H41N3O4 MolecularWeight: 531.68564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCCCCN3CCC(CC3)C4=CC(=CC=C4)NC(=O)C(C)C

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCCCCN3CCC(CC3)C4=CC(=CC=C4)NC(=O)C(C)C

InChI

InChI=1S/C32H41N3O4/c1-23(2)31(36)33-28-15-11-14-27(22-28)25-16-19-35(20-17-25)18-9-4-5-10-21-38-32(37)29-24(3)39-34-30(29)26-12-7-6-8-13-26/h6-8,11-15,22-23,25H,4-5,9-10,16-21H2,1-3H3,(H,33,36)