(1-cyano-6,10,11-trimethoxy-12-oxidanyl-1,2,3,4-tetrahydrotetracen-5-yl) 2,2-dimethylpropanoate

Systemtic Name: (1-cyano-6,10,11-trimethoxy-12-oxidanyl-1,2,3,4-tetrahydrotetracen-5-yl) 2,2-dimethylpropanoate Openeye Name: (1-cyano-12-hydroxy-6,10,11-trimethoxy-1,2,3,4-tetrahydrotetracen-5-yl) 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid (1-cyano-12-hydroxy-6,10,11-trimethoxy-1,2,3,4-tetrahydrotetracen-5-yl) ester IUPAC Name: (1-cyano-12-hydroxy-6,10,11-trimethoxy-1,2,3,4-tetrahydrotetracen-5-yl) 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid (1-cyano-12-hydroxy-6,10,11-trimethoxy-1,2,3,4-tetrahydrotetracen-5-yl) ester Formula: C27H29NO6 MolecularWeight: 463.52226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=C2CCCC(C2=C(C3=C(C4=C(C=CC=C4OC)C(=C31)OC)OC)O)C#N

Isomeric SMILES

CC(C)(C)C(=O)OC1=C2CCCC(C2=C(C3=C(C4=C(C=CC=C4OC)C(=C31)OC)OC)O)C#N

InChI

InChI=1S/C27H29NO6/c1-27(2,3)26(30)34-24-15-10-7-9-14(13-28)18(15)22(29)20-21(24)23(32-5)16-11-8-12-17(31-4)19(16)25(20)33-6/h8,11-12,14,29H,7,9-10H2,1-6H3