(4S)-2-azanyl-4-(1,3-benzodioxol-5-yl)-6-phenyl-4H-pyran-3,5-dicarbonitrile

Systemtic Name: (4S)-2-azanyl-4-(1,3-benzodioxol-5-yl)-6-phenyl-4H-pyran-3,5-dicarbonitrile Openeye Name: (4S)-2-amino-4-(1,3-benzodioxol-5-yl)-6-phenyl-4H-pyran-3,5-dicarbonitrile CAS Name: (4S)-2-amino-4-(1,3-benzodioxol-5-yl)-6-phenyl-4H-pyran-3,5-dicarbonitrile IUPAC Name: (4S)-2-amino-4-(1,3-benzodioxol-5-yl)-6-phenyl-4H-pyran-3,5-dicarbonitrile Traditional Name: (4S)-2-amino-4-(1,3-benzodioxol-5-yl)-6-phenyl-4H-pyran-3,5-dicarbonitrile Formula: C20H13N3O3 MolecularWeight: 343.33552

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3C(=C(OC(=C3C#N)N)C4=CC=CC=C4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)[C@H]3C(=C(OC(=C3C#N)N)C4=CC=CC=C4)C#N

InChI

InChI=1S/C20H13N3O3/c21-9-14-18(13-6-7-16-17(8-13)25-11-24-16)15(10-22)20(23)26-19(14)12-4-2-1-3-5-12/h1-8,18H,11,23H2/t18-/m0/s1