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

Systemtic Name: 2-azanyl-4-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Openeye Name: 4-(4-allyloxy-3-bromo-5-methoxy-phenyl)-2-amino-4H-benzo[h]chromene-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-4H-benzo[h][1]benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile Traditional Name: 4-(4-allyloxy-3-bromo-5-methoxy-phenyl)-2-amino-4H-benzo[h]chromene-3-carbonitrile Formula: C24H19BrN2O3 MolecularWeight: 463.32326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H19BrN2O3/c1-3-10-29-23-19(25)11-15(12-20(23)28-2)21-17-9-8-14-6-4-5-7-16(14)22(17)30-24(27)18(21)13-26/h3-9,11-12,21H,1,10,27H2,2H3