(3S)-3-(4-ethylphenyl)-3-(3-oxidanylidene-1H-isoindol-2-yl)propanoate

Systemtic Name: (3S)-3-(4-ethylphenyl)-3-(3-oxidanylidene-1H-isoindol-2-yl)propanoate Openeye Name: (3S)-3-(4-ethylphenyl)-3-(1-oxoisoindolin-2-yl)propanoate CAS Name: (3S)-3-(4-ethylphenyl)-3-(3-oxo-1H-isoindol-2-yl)propanoate IUPAC Name: (3S)-3-(4-ethylphenyl)-3-(3-oxo-1H-isoindol-2-yl)propanoate Traditional Name: (3S)-3-(4-ethylphenyl)-3-(1-ketoisoindolin-2-yl)propionate Formula: C19H18NO3- MolecularWeight: 308.35112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CC(=O)[O-])N2CC3=CC=CC=C3C2=O

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CC(=O)[O-])N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H19NO3/c1-2-13-7-9-14(10-8-13)17(11-18(21)22)20-12-15-5-3-4-6-16(15)19(20)23/h3-10,17H,2,11-12H2,1H3,(H,21,22)/p-1/t17-/m0/s1