sodium 4-(1,2-dihydroacenaphthylen-4-yl)-4-oxidanyl-butanoate

Systemtic Name: sodium 4-(1,2-dihydroacenaphthylen-4-yl)-4-oxidanyl-butanoate Openeye Name: sodium 4-(1,2-dihydroacenaphthylen-4-yl)-4-hydroxy-butanoate CAS Name: sodium 4-(1,2-dihydroacenaphthylen-4-yl)-4-hydroxybutanoate IUPAC Name: sodium 4-(1,2-dihydroacenaphthylen-4-yl)-4-hydroxybutanoate Traditional Name: sodium 4-acenaphthen-4-yl-4-hydroxy-butyrate Formula: C16H15NaO3 MolecularWeight: 278.27827

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C3C1=CC=CC3=CC(=C2)C(CCC(=O)[O-])O.[Na+]

Isomeric SMILES

C1CC2=C3C1=CC=CC3=CC(=C2)C(CCC(=O)[O-])O.[Na+]

InChI

InChI=1S/C16H16O3.Na/c17-14(6-7-15(18)19)13-8-11-3-1-2-10-4-5-12(9-13)16(10)11;/h1-3,8-9,14,17H,4-7H2,(H,18,19);/q;+1/p-1