(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-(3-methylbutyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 2-isopentyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(3-methylbutyl)-1,3-dioxo-5-isoindolecarboxylic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 2-(3-methylbutyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-isoamyl-1,3-diketo-isoindoline-5-carboxylic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C22H22N2O5/c1-13(2)10-11-24-20(26)16-9-8-15(12-17(16)21(24)27)22(28)29-18(19(23)25)14-6-4-3-5-7-14/h3-9,12-13,18H,10-11H2,1-2H3,(H2,23,25)