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

Systemtic Name: [2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methyl-azanium Openeye Name: [2-(3-acetamidoanilino)-2-oxo-ethyl]-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methyl-ammonium CAS Name: [2-(3-acetamidoanilino)-2-oxoethyl]-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methylammonium IUPAC Name: [2-(3-acetamidoanilino)-2-oxoethyl]-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methylazanium Traditional Name: [2-(3-acetamidoanilino)-2-keto-ethyl]-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methyl-ammonium Formula: C20H24N3O4+ MolecularWeight: 370.42226

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H23N3O4/c1-14(24)21-16-4-3-5-17(11-16)22-20(25)13-23(2)12-15-6-7-18-19(10-15)27-9-8-26-18/h3-7,10-11H,8-9,12-13H2,1-2H3,(H,21,24)(H,22,25)/p+1