methyl 4-[4-(2-naphthalen-2-ylethyl)-3-oxidanylidene-1,2-oxazol-5-yl]piperidine-1-carboxylate

Systemtic Name: methyl 4-[4-(2-naphthalen-2-ylethyl)-3-oxidanylidene-1,2-oxazol-5-yl]piperidine-1-carboxylate Openeye Name: methyl 4-[4-[2-(2-naphthyl)ethyl]-3-oxo-isoxazol-5-yl]piperidine-1-carboxylate CAS Name: 4-[4-[2-(2-naphthalenyl)ethyl]-3-oxo-5-isoxazolyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-(2-naphthalen-2-ylethyl)-3-oxo-1,2-oxazol-5-yl]piperidine-1-carboxylate Traditional Name: 4-[3-keto-4-[2-(2-naphthyl)ethyl]-4-isoxazolin-5-yl]piperidine-1-carboxylic acid methyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC(CC1)C2=C(C(=O)NO2)CCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)N1CCC(CC1)C2=C(C(=O)NO2)CCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H24N2O4/c1-27-22(26)24-12-10-17(11-13-24)20-19(21(25)23-28-20)9-7-15-6-8-16-4-2-3-5-18(16)14-15/h2-6,8,14,17H,7,9-13H2,1H3,(H,23,25)