2,3-dihydro-1,4-benzodioxin-6-ylmethyl-methyl-[2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl]azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-methyl-[2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl]azanium Openeye Name: [2-(2-benzoylanilino)-2-oxo-ethyl]-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methyl-ammonium CAS Name: [2-(2-benzoylanilino)-2-oxoethyl]-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methylammonium IUPAC Name: [2-(2-benzoylanilino)-2-oxoethyl]-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methylazanium Traditional Name: [2-(2-benzoylanilino)-2-keto-ethyl]-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methyl-ammonium Formula: C25H25N2O4+ MolecularWeight: 417.477

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCCO2)CC(=O)NC3=CC=CC=C3C(=O)C4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCCO2)CC(=O)NC3=CC=CC=C3C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2O4/c1-27(16-18-11-12-22-23(15-18)31-14-13-30-22)17-24(28)26-21-10-6-5-9-20(21)25(29)19-7-3-2-4-8-19/h2-12,15H,13-14,16-17H2,1H3,(H,26,28)/p+1