sodium 1-methanoyl-3,4-bis(2-methylpropyl)naphthalene-2-carboxylate

Systemtic Name: sodium 1-methanoyl-3,4-bis(2-methylpropyl)naphthalene-2-carboxylate Openeye Name: sodium 1-formyl-3,4-diisobutyl-naphthalene-2-carboxylate CAS Name: sodium 1-formyl-3,4-bis(2-methylpropyl)-2-naphthalenecarboxylate IUPAC Name: sodium 1-formyl-3,4-bis(2-methylpropyl)naphthalene-2-carboxylate Traditional Name: sodium 1-formyl-3,4-diisobutyl-2-naphthoate Formula: C20H23NaO3 MolecularWeight: 334.38459

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=C(C2=CC=CC=C21)C=O)C(=O)[O-])CC(C)C.[Na+]

Isomeric SMILES

CC(C)CC1=C(C(=C(C2=CC=CC=C21)C=O)C(=O)[O-])CC(C)C.[Na+]

InChI

InChI=1S/C20H24O3.Na/c1-12(2)9-16-14-7-5-6-8-15(14)18(11-21)19(20(22)23)17(16)10-13(3)4;/h5-8,11-13H,9-10H2,1-4H3,(H,22,23);/q;+1/p-1