(5-methoxy-2,2-dimethyl-10-oxidanyl-4-oxidanylidene-1,3-dihydroanthracen-9-yl) thiocyanate

Systemtic Name: (5-methoxy-2,2-dimethyl-10-oxidanyl-4-oxidanylidene-1,3-dihydroanthracen-9-yl) thiocyanate Openeye Name: (10-hydroxy-5-methoxy-2,2-dimethyl-4-oxo-1,3-dihydroanthracen-9-yl) thiocyanate CAS Name: thiocyanic acid (10-hydroxy-5-methoxy-2,2-dimethyl-4-oxo-1,3-dihydroanthracen-9-yl) ester IUPAC Name: (10-hydroxy-5-methoxy-2,2-dimethyl-4-oxo-1,3-dihydroanthracen-9-yl) thiocyanate Traditional Name: thiocyanic acid (10-hydroxy-4-keto-5-methoxy-2,2-dimethyl-1,3-dihydroanthracen-9-yl) ester Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C3=C(C(=CC=C3)OC)C(=C2C(=O)C1)O)SC#N)C

Isomeric SMILES

CC1(CC2=C(C3=C(C(=CC=C3)OC)C(=C2C(=O)C1)O)SC#N)C

InChI

InChI=1S/C18H17NO3S/c1-18(2)7-11-14(12(20)8-18)16(21)15-10(17(11)23-9-19)5-4-6-13(15)22-3/h4-6,21H,7-8H2,1-3H3