[2-[1,3-benzodioxol-5-ylmethyl-[(4-phenylphenyl)methyl]amino]-2-oxidanylidene-ethyl]-dimethyl-azanium

Systemtic Name: [2-[1,3-benzodioxol-5-ylmethyl-[(4-phenylphenyl)methyl]amino]-2-oxidanylidene-ethyl]-dimethyl-azanium Openeye Name: [2-[1,3-benzodioxol-5-ylmethyl-[(4-phenylphenyl)methyl]amino]-2-oxo-ethyl]-dimethyl-ammonium CAS Name: [2-[1,3-benzodioxol-5-ylmethyl-[(4-phenylphenyl)methyl]amino]-2-oxoethyl]-dimethylammonium IUPAC Name: [2-[1,3-benzodioxol-5-ylmethyl-[(4-phenylphenyl)methyl]amino]-2-oxoethyl]-dimethylazanium Traditional Name: [2-keto-2-[(4-phenylbenzyl)-piperonyl-amino]ethyl]-dimethyl-ammonium Formula: C25H27N2O3+ MolecularWeight: 403.49348

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[NH+](C)CC(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H26N2O3/c1-26(2)17-25(28)27(16-20-10-13-23-24(14-20)30-18-29-23)15-19-8-11-22(12-9-19)21-6-4-3-5-7-21/h3-14H,15-18H2,1-2H3/p+1