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

Systemtic Name: 3-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]propyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Openeye Name: 3-[4-[3-(2-methylpropanoylamino)phenyl]-1-piperidyl]propyl 5-methyl-3-phenyl-isoxazole-4-carboxylate CAS Name: 5-methyl-3-phenyl-4-isoxazolecarboxylic acid 3-[4-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-1-piperidinyl]propyl ester IUPAC Name: 3-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]propyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-phenyl-isoxazole-4-carboxylic acid 3-[4-[3-(isobutyrylamino)phenyl]piperidino]propyl ester Formula: C29H35N3O4 MolecularWeight: 489.6059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCN3CCC(CC3)C4=CC(=CC=C4)NC(=O)C(C)C

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCCCN3CCC(CC3)C4=CC(=CC=C4)NC(=O)C(C)C

InChI

InChI=1S/C29H35N3O4/c1-20(2)28(33)30-25-12-7-11-24(19-25)22-13-16-32(17-14-22)15-8-18-35-29(34)26-21(3)36-31-27(26)23-9-5-4-6-10-23/h4-7,9-12,19-20,22H,8,13-18H2,1-3H3,(H,30,33)