[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]ammonium CAS Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium Traditional Name: [2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]-cyclopropyl-p-anisyl-ammonium Formula: C20H23N2O4+ MolecularWeight: 355.40762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+](CC(=O)NC2=CC3=C(C=C2)OCO3)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+](CC(=O)NC2=CC3=C(C=C2)OCO3)C4CC4

InChI

InChI=1S/C20H22N2O4/c1-24-17-7-2-14(3-8-17)11-22(16-5-6-16)12-20(23)21-15-4-9-18-19(10-15)26-13-25-18/h2-4,7-10,16H,5-6,11-13H2,1H3,(H,21,23)/p+1