tert-butyl-[3-(9H-xanthen-9-ylcarbonylamino)propyl]azanium

Systemtic Name: tert-butyl-[3-(9H-xanthen-9-ylcarbonylamino)propyl]azanium Openeye Name: tert-butyl-[3-(9H-xanthene-9-carbonylamino)propyl]ammonium CAS Name: tert-butyl-[3-[[oxo(9H-xanthen-9-yl)methyl]amino]propyl]ammonium IUPAC Name: tert-butyl-[3-(9H-xanthene-9-carbonylamino)propyl]azanium Traditional Name: tert-butyl-[3-(9H-xanthene-9-carbonylamino)propyl]ammonium Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CCCNC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13

Isomeric SMILES

CC(C)(C)[NH2+]CCCNC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13

InChI

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