3-[3-[(4-bromophenyl)carbonylamino]propanoylamino]propyl-tert-butyl-azanium

Systemtic Name: 3-[3-[(4-bromophenyl)carbonylamino]propanoylamino]propyl-tert-butyl-azanium Openeye Name: 3-[3-[(4-bromobenzoyl)amino]propanoylamino]propyl-tert-butyl-ammonium CAS Name: 3-[[3-[[(4-bromophenyl)-oxomethyl]amino]-1-oxopropyl]amino]propyl-tert-butylammonium IUPAC Name: 3-[3-[(4-bromobenzoyl)amino]propanoylamino]propyl-tert-butylazanium Traditional Name: 3-[3-[(4-bromobenzoyl)amino]propanoylamino]propyl-tert-butyl-ammonium Formula: C17H27BrN3O2+ MolecularWeight: 385.31918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CCCNC(=O)CCNC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)(C)[NH2+]CCCNC(=O)CCNC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C17H26BrN3O2/c1-17(2,3)21-11-4-10-19-15(22)9-12-20-16(23)13-5-7-14(18)8-6-13/h5-8,21H,4,9-12H2,1-3H3,(H,19,22)(H,20,23)/p+1