(phenylmethyl) (2S)-6-azido-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-methyl-heptanoate

Systemtic Name: (phenylmethyl) (2S)-6-azido-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-methyl-heptanoate Openeye Name: benzyl (2S)-6-azido-2-(1,3-dioxoisoindolin-2-yl)-6-methyl-heptanoate CAS Name: (2S)-6-azido-2-(1,3-dioxo-2-isoindolyl)-6-methylheptanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-6-azido-2-(1,3-dioxoisoindol-2-yl)-6-methylheptanoate Traditional Name: (2S)-6-azido-6-methyl-2-phthalimido-enanthic acid benzyl ester Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(C(=O)OCC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2=O)N=[N+]=[N-]

Isomeric SMILES

CC(C)(CCC[C@@H](C(=O)OCC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2=O)N=[N+]=[N-]

InChI

InChI=1S/C23H24N4O4/c1-23(2,25-26-24)14-8-13-19(22(30)31-15-16-9-4-3-5-10-16)27-20(28)17-11-6-7-12-18(17)21(27)29/h3-7,9-12,19H,8,13-15H2,1-2H3/t19-/m0/s1