2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-4H-chromene-3-carbonitrile Formula: C18H15BrN2O3 MolecularWeight: 387.2273

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C3=CC=CC=C3OC(=C2C#N)N)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C3=CC=CC=C3OC(=C2C#N)N)Br)OC

InChI

InChI=1S/C18H15BrN2O3/c1-22-15-8-10(7-13(19)17(15)23-2)16-11-5-3-4-6-14(11)24-18(21)12(16)9-20/h3-8,16H,21H2,1-2H3