beryllium 3-(1,3-benzothiazol-3-ium-2-yl)-1-methyl-2-oxidanylidene-quinolin-4-olate

Systemtic Name: beryllium 3-(1,3-benzothiazol-3-ium-2-yl)-1-methyl-2-oxidanylidene-quinolin-4-olate Openeye Name: beryllium 3-(1,3-benzothiazol-3-ium-2-yl)-1-methyl-2-oxo-quinolin-4-olate CAS Name: beryllium 3-(1,3-benzothiazol-3-ium-2-yl)-1-methyl-2-oxo-4-quinolinolate IUPAC Name: beryllium 3-(1,3-benzothiazol-3-ium-2-yl)-1-methyl-2-oxoquinolin-4-olate Traditional Name: beryllium 3-(1,3-benzothiazol-3-ium-2-yl)-2-keto-1-methyl-quinolin-4-olate Formula: C17H12BeN2O2S+2 MolecularWeight: 317.366562

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Descriptors Computed from Structure

Canonical SMILES:

[Be+2].CN1C2=CC=CC=C2C(=C(C1=O)C3=[NH+]C4=CC=CC=C4S3)[O-]

Isomeric SMILES

[Be+2].CN1C2=CC=CC=C2C(=C(C1=O)C3=[NH+]C4=CC=CC=C4S3)[O-]

InChI

InChI=1S/C17H12N2O2S.Be/c1-19-12-8-4-2-6-10(12)15(20)14(17(19)21)16-18-11-7-3-5-9-13(11)22-16;/h2-9,20H,1H3;/q;+2