1,3-benzodioxol-5-ylmethyl-(phenylmethyl)-[[5-(propan-2-ylcarbamoyl)furan-2-yl]methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-(phenylmethyl)-[[5-(propan-2-ylcarbamoyl)furan-2-yl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-benzyl-[[5-(isopropylcarbamoyl)-2-furyl]methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[5-[oxo-(propan-2-ylamino)methyl]-2-furanyl]methyl]-(phenylmethyl)ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-benzyl-[[5-(propan-2-ylcarbamoyl)furan-2-yl]methyl]azanium Traditional Name: benzyl-[[5-(isopropylcarbamoyl)-2-furyl]methyl]-piperonyl-ammonium Formula: C24H27N2O4+ MolecularWeight: 407.48218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=C(O1)C[NH+](CC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)NC(=O)C1=CC=C(O1)C[NH+](CC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H26N2O4/c1-17(2)25-24(27)22-11-9-20(30-22)15-26(13-18-6-4-3-5-7-18)14-19-8-10-21-23(12-19)29-16-28-21/h3-12,17H,13-16H2,1-2H3,(H,25,27)/p+1