2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile Openeye Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile CAS Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile Traditional Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile Formula: C18H18BrN3O2 MolecularWeight: 388.25842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(C(=C(O1)N)C#N)C2=CC(=C(C=C2)OC)Br)C#N

Isomeric SMILES

CC(C)(C)C1=C(C(C(=C(O1)N)C#N)C2=CC(=C(C=C2)OC)Br)C#N

InChI

InChI=1S/C18H18BrN3O2/c1-18(2,3)16-11(8-20)15(12(9-21)17(22)24-16)10-5-6-14(23-4)13(19)7-10/h5-7,15H,22H2,1-4H3