2-azanyl-4-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-7-oxidanyl-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-7-oxidanyl-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-5-ethoxy-4-methoxy-phenyl)-7-hydroxy-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-5-ethoxy-4-methoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-5-ethoxy-4-methoxyphenyl)-7-hydroxy-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-5-ethoxy-4-methoxy-phenyl)-7-hydroxy-4H-chromene-3-carbonitrile Formula: C19H17BrN2O4 MolecularWeight: 417.25328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C3=C(C=C(C=C3)O)OC(=C2C#N)N)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C3=C(C=C(C=C3)O)OC(=C2C#N)N)Br)OC

InChI

InChI=1S/C19H17BrN2O4/c1-3-25-16-7-10(6-14(20)18(16)24-2)17-12-5-4-11(23)8-15(12)26-19(22)13(17)9-21/h4-8,17,23H,3,22H2,1-2H3