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

Systemtic Name: (4R)-2-azanyl-4-(2-bromanyl-4-ethoxy-5-methoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Openeye Name: (4R)-2-amino-4-(2-bromo-4-ethoxy-5-methoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile CAS Name: (4R)-2-amino-4-(2-bromo-4-ethoxy-5-methoxyphenyl)-4H-benzo[h][1]benzopyran-3-carbonitrile IUPAC Name: (4R)-2-amino-4-(2-bromo-4-ethoxy-5-methoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile Traditional Name: (4R)-2-amino-4-(2-bromo-4-ethoxy-5-methoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Formula: C23H19BrN2O3 MolecularWeight: 451.31256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19BrN2O3/c1-3-28-20-11-18(24)16(10-19(20)27-2)21-15-9-8-13-6-4-5-7-14(13)22(15)29-23(26)17(21)12-25/h4-11,21H,3,26H2,1-2H3/t21-/m0/s1