N-butyl-5-methyl-3-[4-[4-(phenylmethyl)piperidin-1-yl]carbonylphenyl]-4H-1,2-oxazole-5-carboxamide

Systemtic Name: N-butyl-5-methyl-3-[4-[4-(phenylmethyl)piperidin-1-yl]carbonylphenyl]-4H-1,2-oxazole-5-carboxamide Openeye Name: 3-[4-(4-benzylpiperidine-1-carbonyl)phenyl]-N-butyl-5-methyl-4H-isoxazole-5-carboxamide CAS Name: N-butyl-5-methyl-3-[4-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]phenyl]-4H-isoxazole-5-carboxamide IUPAC Name: 3-[4-(4-benzylpiperidine-1-carbonyl)phenyl]-N-butyl-5-methyl-4H-1,2-oxazole-5-carboxamide Traditional Name: 3-[4-(4-benzylpiperidine-1-carbonyl)phenyl]-N-butyl-5-methyl-2-isoxazoline-5-carboxamide Formula: C28H35N3O3 MolecularWeight: 461.5958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1(CC(=NO1)C2=CC=C(C=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CCCCNC(=O)C1(CC(=NO1)C2=CC=C(C=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C28H35N3O3/c1-3-4-16-29-27(33)28(2)20-25(30-34-28)23-10-12-24(13-11-23)26(32)31-17-14-22(15-18-31)19-21-8-6-5-7-9-21/h5-13,22H,3-4,14-20H2,1-2H3,(H,29,33)