N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-N-(phenylmethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-N-(phenylmethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-benzyl-N-[2-(2-furylmethylamino)-2-oxo-ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-N-(phenylmethyl)-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-benzyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-benzyl-N-[2-(2-furfurylamino)-2-keto-ethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)N(CC3=CC=CC=C3)CC(=O)NCC4=CC=CO4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)N(CC3=CC=CC=C3)CC(=O)NCC4=CC=CO4

InChI

InChI=1S/C23H22N2O5/c26-22(24-14-19-7-4-10-28-19)16-25(15-17-5-2-1-3-6-17)23(27)18-8-9-20-21(13-18)30-12-11-29-20/h1-10,13H,11-12,14-16H2,(H,24,26)