3-(2-benzo[e][1]benzofuran-1-ylethanoylamino)propyl-tert-butyl-azanium

Systemtic Name: 3-(2-benzo[e][1]benzofuran-1-ylethanoylamino)propyl-tert-butyl-azanium Openeye Name: 3-[(2-benzo[e]benzofuran-1-ylacetyl)amino]propyl-tert-butyl-ammonium CAS Name: 3-[[2-(1-benzo[e]benzofuranyl)-1-oxoethyl]amino]propyl-tert-butylammonium IUPAC Name: 3-[(2-benzo[e][1]benzofuran-1-ylacetyl)amino]propyl-tert-butylazanium Traditional Name: 3-[(2-benzo[e]benzofuran-1-ylacetyl)amino]propyl-tert-butyl-ammonium Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CCCNC(=O)CC1=COC2=C1C3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)(C)[NH2+]CCCNC(=O)CC1=COC2=C1C3=CC=CC=C3C=C2

InChI

InChI=1S/C21H26N2O2/c1-21(2,3)23-12-6-11-22-19(24)13-16-14-25-18-10-9-15-7-4-5-8-17(15)20(16)18/h4-5,7-10,14,23H,6,11-13H2,1-3H3,(H,22,24)/p+1