2-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]ethyl]ammonium CAS Name: 2-[[1-oxo-4-(2-oxo-1,3-benzoxazol-3-yl)butyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-[4-(2-keto-1,3-benzoxazol-3-yl)butanoylamino]ethyl]ammonium Formula: C19H30N3O3+ MolecularWeight: 348.4598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)CCCN1C2=CC=CC=C2OC1=O)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)CCCN1C2=CC=CC=C2OC1=O)C(C)C

InChI

InChI=1S/C19H29N3O3/c1-14(2)21(15(3)4)13-11-20-18(23)10-7-12-22-16-8-5-6-9-17(16)25-19(22)24/h5-6,8-9,14-15H,7,10-13H2,1-4H3,(H,20,23)/p+1