2-azanyl-4-(2-bromanyl-4,5-dimethoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2-bromanyl-4,5-dimethoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Openeye Name: 2-amino-4-(2-bromo-4,5-dimethoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile CAS Name: 2-amino-4-(2-bromo-4,5-dimethoxyphenyl)-4H-benzo[h][1]benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(2-bromo-4,5-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile Traditional Name: 2-amino-4-(2-bromo-4,5-dimethoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Formula: C22H17BrN2O3 MolecularWeight: 437.28598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)Br)OC

InChI

InChI=1S/C22H17BrN2O3/c1-26-18-9-15(17(23)10-19(18)27-2)20-14-8-7-12-5-3-4-6-13(12)21(14)28-22(25)16(20)11-24/h3-10,20H,25H2,1-2H3