2-[3-(3-azanyl-4-morpholin-4-yl-phenyl)propanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-(3-azanyl-4-morpholin-4-yl-phenyl)propanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[3-(3-amino-4-morpholino-phenyl)propanoylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[3-[3-amino-4-(4-morpholinyl)phenyl]-1-oxopropyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[3-(3-amino-4-morpholin-4-ylphenyl)propanoylamino]ethyl-dimethylazanium Traditional Name: 2-[3-(3-amino-4-morpholino-phenyl)propanoylamino]ethyl-dimethyl-ammonium Formula: C17H29N4O2+ MolecularWeight: 321.43776

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)CCC1=CC(=C(C=C1)N2CCOCC2)N

Isomeric SMILES

C[NH+](C)CCNC(=O)CCC1=CC(=C(C=C1)N2CCOCC2)N

InChI

InChI=1S/C17H28N4O2/c1-20(2)8-7-19-17(22)6-4-14-3-5-16(15(18)13-14)21-9-11-23-12-10-21/h3,5,13H,4,6-12,18H2,1-2H3,(H,19,22)/p+1