N-[3-chloranyl-4-[5-(hydroxymethyl)furan-2-yl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[3-chloranyl-4-[5-(hydroxymethyl)furan-2-yl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[3-chloro-4-[5-(hydroxymethyl)-2-furyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[3-chloro-4-[5-(hydroxymethyl)-2-furanyl]phenyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[3-chloro-4-[5-(hydroxymethyl)furan-2-yl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[3-chloro-4-(5-methylol-2-furyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C20H16ClNO5 MolecularWeight: 385.79774

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)NC3=CC(=C(C=C3)C4=CC=C(O4)CO)Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)NC3=CC(=C(C=C3)C4=CC=C(O4)CO)Cl

InChI

InChI=1S/C20H16ClNO5/c21-16-10-13(2-4-15(16)17-6-3-14(11-23)27-17)22-20(24)12-1-5-18-19(9-12)26-8-7-25-18/h1-6,9-10,23H,7-8,11H2,(H,22,24)