disodium 4-(8-methyl-2-oxidanylidene-1H-quinolin-6-yl)benzoate

Systemtic Name: disodium 4-(8-methyl-2-oxidanylidene-1H-quinolin-6-yl)benzoate Openeye Name: disodium 4-(8-methyl-2-oxo-1H-quinolin-6-yl)benzoate CAS Name: disodium 4-(8-methyl-2-oxo-1H-quinolin-6-yl)benzoate IUPAC Name: disodium 4-(8-methyl-2-oxo-1H-quinolin-6-yl)benzoate Traditional Name: disodium 4-(2-keto-8-methyl-1H-quinolin-6-yl)benzoate Formula: C34H24N2Na2O6 MolecularWeight: 602.5437

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C3=CC=C(C=C3)C(=O)[O-])C=CC(=O)N2.CC1=C2C(=CC(=C1)C3=CC=C(C=C3)C(=O)[O-])C=CC(=O)N2.[Na+].[Na+]

Isomeric SMILES

CC1=C2C(=CC(=C1)C3=CC=C(C=C3)C(=O)[O-])C=CC(=O)N2.CC1=C2C(=CC(=C1)C3=CC=C(C=C3)C(=O)[O-])C=CC(=O)N2.[Na+].[Na+]

InChI

InChI=1S/2C17H13NO3.2Na/c2*1-10-8-14(9-13-6-7-15(19)18-16(10)13)11-2-4-12(5-3-11)17(20)21;;/h2*2-9H,1H3,(H,18,19)(H,20,21);;/q;;2*+1/p-2