2-(1,3-benzodioxol-5-yl)ethyl-[(1R)-2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(1R)-2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(1R)-2-(3-methoxyanilino)-2-oxo-1-phenyl-ethyl]ammonium CAS Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(1R)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl]ammonium IUPAC Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(1R)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl]azanium Traditional Name: homopiperonyl-[(1R)-2-keto-2-(m-anisidino)-1-phenyl-ethyl]ammonium Formula: C24H25N2O4+ MolecularWeight: 405.4663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)[NH2+]CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)[C@@H](C2=CC=CC=C2)[NH2+]CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H24N2O4/c1-28-20-9-5-8-19(15-20)26-24(27)23(18-6-3-2-4-7-18)25-13-12-17-10-11-21-22(14-17)30-16-29-21/h2-11,14-15,23,25H,12-13,16H2,1H3,(H,26,27)/p+1/t23-/m1/s1