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

Systemtic Name: 2-azanyl-4-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-5-ethoxy-4-methoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-5-ethoxy-4-methoxyphenyl)-4H-benzo[h][1]benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-5-ethoxy-4-methoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-5-ethoxy-4-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(=CC(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)Br)OC

Isomeric SMILES

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

InChI

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