2-azanyl-4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-5-ethanoyl-6-methyl-4H-pyran-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-5-ethanoyl-6-methyl-4H-pyran-3-carbonitrile Openeye Name: 5-acetyl-2-amino-4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-6-methyl-4H-pyran-3-carbonitrile CAS Name: 5-acetyl-2-amino-4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-6-methyl-4H-pyran-3-carbonitrile IUPAC Name: 5-acetyl-2-amino-4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-6-methyl-4H-pyran-3-carbonitrile Traditional Name: 5-acetyl-2-amino-4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-6-methyl-4H-pyran-3-carbonitrile Formula: C17H17BrN2O4 MolecularWeight: 393.23188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=C(OC(=C2C(=O)C)C)N)C#N)Br)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=C(OC(=C2C(=O)C)C)N)C#N)Br)O

InChI

InChI=1S/C17H17BrN2O4/c1-4-23-13-6-10(5-12(18)16(13)22)15-11(7-19)17(20)24-9(3)14(15)8(2)21/h5-6,15,22H,4,20H2,1-3H3