sodium 2-[(1S)-2,3-dihydro-1H-inden-1-yl]-4-(1,3-dihydroisoindol-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: sodium 2-[(1S)-2,3-dihydro-1H-inden-1-yl]-4-(1,3-dihydroisoindol-2-yl)-4-oxidanylidene-butanoate Openeye Name: sodium 2-[(1S)-indan-1-yl]-4-isoindolin-2-yl-4-oxo-butanoate CAS Name: sodium 2-[(1S)-2,3-dihydro-1H-inden-1-yl]-4-(1,3-dihydroisoindol-2-yl)-4-oxobutanoate IUPAC Name: sodium 2-[(1S)-2,3-dihydro-1H-inden-1-yl]-4-(1,3-dihydroisoindol-2-yl)-4-oxobutanoate Traditional Name: sodium 2-[(1S)-indan-1-yl]-4-isoindolin-2-yl-4-keto-butyrate Formula: C21H20NNaO3 MolecularWeight: 357.37817

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C1C(CC(=O)N3CC4=CC=CC=C4C3)C(=O)[O-].[Na+]

Isomeric SMILES

C1CC2=CC=CC=C2[C@@H]1C(CC(=O)N3CC4=CC=CC=C4C3)C(=O)[O-].[Na+]

InChI

InChI=1S/C21H21NO3.Na/c23-20(22-12-15-6-1-2-7-16(15)13-22)11-19(21(24)25)18-10-9-14-5-3-4-8-17(14)18;/h1-8,18-19H,9-13H2,(H,24,25);/q;+1/p-1/t18-,19?;/m1./s1