sodium; 1-azanylidene-4-(cyclohexylamino)-2H-anthracen-2-ide-9,10-dione; hydrogen sulfite

Systemtic Name: sodium; 1-azanylidene-4-(cyclohexylamino)-2H-anthracen-2-ide-9,10-dione; hydrogen sulfite Openeye Name: sodium; 4-(cyclohexylamino)-1-imino-2H-anthracen-2-ide-9,10-dione; hydrogen sulfite CAS Name: sodium; 4-(cyclohexylamino)-1-imino-2H-anthracen-2-ide-9,10-dione; hydrogen sulfite IUPAC Name: sodium; 4-(cyclohexylamino)-1-imino-2H-anthracen-2-ide-9,10-dione; hydrogen sulfite Traditional Name: sodium 4-(cyclohexylamino)-1-imino-2H-anthracen-2-ide-9,10-quinone bisulfite Formula: C20H20N2NaO5S- MolecularWeight: 423.43797

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C[CH-]C(=N)C3=C2C(=O)C4=CC=CC=C4C3=O.OS(=O)[O-].[Na+]

Isomeric SMILES

C1CCC(CC1)NC2=C[CH-]C(=N)C3=C2C(=O)C4=CC=CC=C4C3=O.OS(=O)[O-].[Na+]

InChI

InChI=1S/C20H19N2O2.Na.H2O3S/c21-15-10-11-16(22-12-6-2-1-3-7-12)18-17(15)19(23)13-8-4-5-9-14(13)20(18)24;;1-4(2)3/h4-5,8-12,21-22H,1-3,6-7H2;;(H2,1,2,3)/q-1;+1;/p-1