N-[4-(cyanomethyl)phenyl]-5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-5-methoxy-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-5-methoxy-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C18H16N2O4/c1-22-15-10-13(11-16-17(15)24-9-8-23-16)18(21)20-14-4-2-12(3-5-14)6-7-19/h2-5,10-11H,6,8-9H2,1H3,(H,20,21)