2-(1,3-benzodioxol-5-ylamino)-7-methoxy-quinoline-3-carbonitrile

Systemtic Name: 2-(1,3-benzodioxol-5-ylamino)-7-methoxy-quinoline-3-carbonitrile Openeye Name: 2-(1,3-benzodioxol-5-ylamino)-7-methoxy-quinoline-3-carbonitrile CAS Name: 2-(1,3-benzodioxol-5-ylamino)-7-methoxy-3-quinolinecarbonitrile IUPAC Name: 2-(1,3-benzodioxol-5-ylamino)-7-methoxyquinoline-3-carbonitrile Traditional Name: 2-(1,3-benzodioxol-5-ylamino)-7-methoxy-quinoline-3-carbonitrile Formula: C18H13N3O3 MolecularWeight: 319.31412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=N2)NC3=CC4=C(C=C3)OCO4)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=N2)NC3=CC4=C(C=C3)OCO4)C#N

InChI

InChI=1S/C18H13N3O3/c1-22-14-4-2-11-6-12(9-19)18(21-15(11)8-14)20-13-3-5-16-17(7-13)24-10-23-16/h2-8H,10H2,1H3,(H,20,21)