4-azanylidene-2-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizine-3-carbonitrile

Systemtic Name: 4-azanylidene-2-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizine-3-carbonitrile Openeye Name: 2-(3-bromo-4-ethoxy-5-methoxy-phenyl)-4-imino-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizine-3-carbonitrile CAS Name: 2-(3-bromo-4-ethoxy-5-methoxyphenyl)-4-imino-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizine-3-carbonitrile IUPAC Name: 2-(3-bromo-4-ethoxy-5-methoxyphenyl)-4-imino-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizine-3-carbonitrile Traditional Name: 2-(3-bromo-4-ethoxy-5-methoxy-phenyl)-4-imino-6,7-dihydro-[1,3]benzodioxolo[5,6-a]quinolizine-3-carbonitrile Formula: C24H20BrN3O4 MolecularWeight: 494.3373

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C2=C(C(=N)N3CCC4=CC5=C(C=C4C3=C2)OCO5)C#N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C2=C(C(=N)N3CCC4=CC5=C(C=C4C3=C2)OCO5)C#N)OC

InChI

InChI=1S/C24H20BrN3O4/c1-3-30-23-18(25)6-14(8-22(23)29-2)15-9-19-16-10-21-20(31-12-32-21)7-13(16)4-5-28(19)24(27)17(15)11-26/h6-10,27H,3-5,12H2,1-2H3