tert-butyl 3-methyl-6-oxidanylidene-1-(phenylmethyl)-1,2-diazinane-3-carboxylate

Systemtic Name: tert-butyl 3-methyl-6-oxidanylidene-1-(phenylmethyl)-1,2-diazinane-3-carboxylate Openeye Name: tert-butyl 1-benzyl-3-methyl-6-oxo-hexahydropyridazine-3-carboxylate CAS Name: 3-methyl-6-oxo-1-(phenylmethyl)-3-diazinanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-benzyl-3-methyl-6-oxodiazinane-3-carboxylate Traditional Name: 1-benzyl-6-keto-3-methyl-hexahydropyridazine-3-carboxylic acid tert-butyl ester Formula: C17H24N2O3 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)N(N1)CC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1(CCC(=O)N(N1)CC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H24N2O3/c1-16(2,3)22-15(21)17(4)11-10-14(20)19(18-17)12-13-8-6-5-7-9-13/h5-9,18H,10-12H2,1-4H3