2-azanyl-4-(7-methoxy-1,3-benzodioxol-5-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(7-methoxy-1,3-benzodioxol-5-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-5-keto-4-(7-methoxy-1,3-benzodioxol-5-yl)-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C3C(=C(OC4=C3C(=O)CCC4)N)C#N

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)C3C(=C(OC4=C3C(=O)CCC4)N)C#N

InChI

InChI=1S/C18H16N2O5/c1-22-13-5-9(6-14-17(13)24-8-23-14)15-10(7-19)18(20)25-12-4-2-3-11(21)16(12)15/h5-6,15H,2-4,8,20H2,1H3