4-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonylamino]butanoate

Systemtic Name: 4-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonylamino]butanoate Openeye Name: 4-[(9,10-dioxo-2-anthryl)sulfonylamino]butanoate CAS Name: 4-[(9,10-dioxo-2-anthracenyl)sulfonylamino]butanoate IUPAC Name: 4-[(9,10-dioxoanthracen-2-yl)sulfonylamino]butanoate Traditional Name: 4-[(9,10-diketo-2-anthryl)sulfonylamino]butyrate Formula: C18H14NO6S- MolecularWeight: 372.37186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO6S/c20-16(21)6-3-9-19-26(24,25)11-7-8-14-15(10-11)18(23)13-5-2-1-4-12(13)17(14)22/h1-2,4-5,7-8,10,19H,3,6,9H2,(H,20,21)/p-1