6-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonylamino]hexanoate

Systemtic Name: 6-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonylamino]hexanoate Openeye Name: 6-[(9,10-dioxo-2-anthryl)sulfonylamino]hexanoate CAS Name: 6-[(9,10-dioxo-2-anthracenyl)sulfonylamino]hexanoate IUPAC Name: 6-[(9,10-dioxoanthracen-2-yl)sulfonylamino]hexanoate Traditional Name: 6-[(9,10-diketo-2-anthryl)sulfonylamino]hexanoate Formula: C20H18NO6S- MolecularWeight: 400.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)NCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)NCCCCCC(=O)[O-]

InChI

InChI=1S/C20H19NO6S/c22-18(23)8-2-1-5-11-21-28(26,27)13-9-10-16-17(12-13)20(25)15-7-4-3-6-14(15)19(16)24/h3-4,6-7,9-10,12,21H,1-2,5,8,11H2,(H,22,23)/p-1