[3-[[2-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]phenyl] ethanoate

Systemtic Name: [3-[[2-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]phenyl] ethanoate Openeye Name: [3-[(2-butyl-1,3-dioxo-isoindoline-5-carbonyl)amino]phenyl] acetate CAS Name: acetic acid [3-[[(2-butyl-1,3-dioxo-5-isoindolyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [3-[(2-butyl-1,3-dioxoisoindole-5-carbonyl)amino]phenyl] acetate Traditional Name: acetic acid [3-[(2-butyl-1,3-diketo-isoindoline-5-carbonyl)amino]phenyl] ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC(=CC=C3)OC(=O)C

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC(=CC=C3)OC(=O)C

InChI

InChI=1S/C21H20N2O5/c1-3-4-10-23-20(26)17-9-8-14(11-18(17)21(23)27)19(25)22-15-6-5-7-16(12-15)28-13(2)24/h5-9,11-12H,3-4,10H2,1-2H3,(H,22,25)