methyl 5-[[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]methyl]-3-methyl-furan-2-carboxylate

Systemtic Name: methyl 5-[[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]methyl]-3-methyl-furan-2-carboxylate Openeye Name: methyl 5-[[3-(1,3-benzoxazol-2-yl)-1-piperidyl]methyl]-3-methyl-furan-2-carboxylate CAS Name: 5-[[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]methyl]-3-methyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]methyl]-3-methylfuran-2-carboxylate Traditional Name: 5-[[3-(1,3-benzoxazol-2-yl)piperidino]methyl]-3-methyl-furan-2-carboxylic acid methyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CN2CCCC(C2)C3=NC4=CC=CC=C4O3)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)CN2CCCC(C2)C3=NC4=CC=CC=C4O3)C(=O)OC

InChI

InChI=1S/C20H22N2O4/c1-13-10-15(25-18(13)20(23)24-2)12-22-9-5-6-14(11-22)19-21-16-7-3-4-8-17(16)26-19/h3-4,7-8,10,14H,5-6,9,11-12H2,1-2H3