3-azanyl-9-methyl-8-(2-methylpropoxy)-7-(phenylmethyl)-1,5-dioxonane-2,6-dione

Systemtic Name: 3-azanyl-9-methyl-8-(2-methylpropoxy)-7-(phenylmethyl)-1,5-dioxonane-2,6-dione Openeye Name: 3-amino-7-benzyl-8-isobutoxy-9-methyl-1,5-dioxonane-2,6-dione CAS Name: 3-amino-9-methyl-8-(2-methylpropoxy)-7-(phenylmethyl)-1,5-dioxonane-2,6-dione IUPAC Name: 3-amino-7-benzyl-9-methyl-8-(2-methylpropoxy)-1,5-dioxonane-2,6-dione Traditional Name: 3-amino-7-benzyl-8-isobutoxy-9-methyl-1,5-dioxonane-2,6-quinone Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(=O)OCC(C(=O)O1)N)CC2=CC=CC=C2)OCC(C)C

Isomeric SMILES

CC1C(C(C(=O)OCC(C(=O)O1)N)CC2=CC=CC=C2)OCC(C)C

InChI

InChI=1S/C19H27NO5/c1-12(2)10-23-17-13(3)25-19(22)16(20)11-24-18(21)15(17)9-14-7-5-4-6-8-14/h4-8,12-13,15-17H,9-11,20H2,1-3H3