6-azanyl-8-(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)-8H-[1,3]dioxolo[4,5-g]chromene-7-carbonitrile

Systemtic Name: 6-azanyl-8-(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)-8H-[1,3]dioxolo[4,5-g]chromene-7-carbonitrile Openeye Name: 8-(4-allyloxy-3-bromo-5-ethoxy-phenyl)-6-amino-8H-[1,3]dioxolo[4,5-g]chromene-7-carbonitrile CAS Name: 6-amino-8-(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)-8H-[1,3]dioxolo[4,5-g][1]benzopyran-7-carbonitrile IUPAC Name: 6-amino-8-(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)-8H-[1,3]dioxolo[4,5-g]chromene-7-carbonitrile Traditional Name: 8-(4-allyloxy-3-bromo-5-ethoxy-phenyl)-6-amino-8H-[1,3]dioxolo[4,5-g]chromene-7-carbonitrile Formula: C22H19BrN2O5 MolecularWeight: 471.30066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C3=CC4=C(C=C3OC(=C2C#N)N)OCO4)Br)OCC=C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C3=CC4=C(C=C3OC(=C2C#N)N)OCO4)Br)OCC=C

InChI

InChI=1S/C22H19BrN2O5/c1-3-5-27-21-15(23)6-12(7-19(21)26-4-2)20-13-8-17-18(29-11-28-17)9-16(13)30-22(25)14(20)10-24/h3,6-9,20H,1,4-5,11,25H2,2H3