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

Systemtic Name: (4R)-2-azanyl-4-(2-bromanyl-4,5-diethoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Openeye Name: (4R)-2-amino-4-(2-bromo-4,5-diethoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile CAS Name: (4R)-2-amino-4-(2-bromo-4,5-diethoxyphenyl)-4H-benzo[h][1]benzopyran-3-carbonitrile IUPAC Name: (4R)-2-amino-4-(2-bromo-4,5-diethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile Traditional Name: (4R)-2-amino-4-(2-bromo-4,5-diethoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Formula: C24H21BrN2O3 MolecularWeight: 465.33914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[C@@H]2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)Br)OCC

InChI

InChI=1S/C24H21BrN2O3/c1-3-28-20-11-17(19(25)12-21(20)29-4-2)22-16-10-9-14-7-5-6-8-15(14)23(16)30-24(27)18(22)13-26/h5-12,22H,3-4,27H2,1-2H3/t22-/m0/s1