(diphenylmethyl)-[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (diphenylmethyl)-[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl]-benzhydryl-methyl-ammonium CAS Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl]-(diphenylmethyl)-methylammonium IUPAC Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl]-benzhydryl-methylazanium Traditional Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-keto-ethyl]-benzhydryl-methyl-ammonium Formula: C25H25N2O4+ MolecularWeight: 417.477

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C[NH+](C)C(C3=CC=CC=C3)C4=CC=CC=C4)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C[NH+](C)C(C3=CC=CC=C3)C4=CC=CC=C4)OCO2

InChI

InChI=1S/C25H24N2O4/c1-17(28)20-13-22-23(31-16-30-22)14-21(20)26-24(29)15-27(2)25(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-14,25H,15-16H2,1-2H3,(H,26,29)/p+1