5-methyl-3-[3-[4-(phenylmethyl)piperidin-1-yl]carbonylphenyl]-4H-1,2-oxazole-5-carboxylic acid

Systemtic Name: 5-methyl-3-[3-[4-(phenylmethyl)piperidin-1-yl]carbonylphenyl]-4H-1,2-oxazole-5-carboxylic acid Openeye Name: 3-[3-(4-benzylpiperidine-1-carbonyl)phenyl]-5-methyl-4H-isoxazole-5-carboxylic acid CAS Name: 5-methyl-3-[3-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]phenyl]-4H-isoxazole-5-carboxylic acid IUPAC Name: 3-[3-(4-benzylpiperidine-1-carbonyl)phenyl]-5-methyl-4H-1,2-oxazole-5-carboxylic acid Traditional Name: 3-[3-(4-benzylpiperidine-1-carbonyl)phenyl]-5-methyl-2-isoxazoline-5-carboxylic acid Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NO1)C2=CC(=CC=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1(CC(=NO1)C2=CC(=CC=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H26N2O4/c1-24(23(28)29)16-21(25-30-24)19-8-5-9-20(15-19)22(27)26-12-10-18(11-13-26)14-17-6-3-2-4-7-17/h2-9,15,18H,10-14,16H2,1H3,(H,28,29)