6-methyl-7-[(2-methylpropan-2-yl)oxy]-5,7-bis(oxidanylidene)-2-(phenylmethoxycarbonylamino)heptanoic acid

Systemtic Name: 6-methyl-7-[(2-methylpropan-2-yl)oxy]-5,7-bis(oxidanylidene)-2-(phenylmethoxycarbonylamino)heptanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-7-tert-butoxy-6-methyl-5,7-dioxo-heptanoic acid CAS Name: 6-methyl-7-[(2-methylpropan-2-yl)oxy]-5,7-dioxo-2-(phenylmethoxycarbonylamino)heptanoic acid IUPAC Name: 6-methyl-7-[(2-methylpropan-2-yl)oxy]-5,7-dioxo-2-(phenylmethoxycarbonylamino)heptanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-7-tert-butoxy-5,7-diketo-6-methyl-enanthic acid Formula: C20H27NO7 MolecularWeight: 393.43088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)CCC(C(=O)O)NC(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C(=O)CCC(C(=O)O)NC(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H27NO7/c1-13(18(25)28-20(2,3)4)16(22)11-10-15(17(23)24)21-19(26)27-12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3,(H,21,26)(H,23,24)