[(2S)-2-[6-(aminocarbonylamino)hexanoylamino]-2-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(2S)-2-[6-(aminocarbonylamino)hexanoylamino]-2-phenyl-ethyl]-dimethyl-azanium Openeye Name: dimethyl-[(2S)-2-phenyl-2-(6-ureidohexanoylamino)ethyl]ammonium CAS Name: [(2S)-2-[[6-(carbamoylamino)-1-oxohexyl]amino]-2-phenylethyl]-dimethylammonium IUPAC Name: [(2S)-2-[6-(carbamoylamino)hexanoylamino]-2-phenylethyl]-dimethylazanium Traditional Name: dimethyl-[(2S)-2-phenyl-2-(6-ureidohexanoylamino)ethyl]ammonium Formula: C17H29N4O2+ MolecularWeight: 321.43776

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(C1=CC=CC=C1)NC(=O)CCCCCNC(=O)N

Isomeric SMILES

C[NH+](C)C[C@H](C1=CC=CC=C1)NC(=O)CCCCCNC(=O)N

InChI

InChI=1S/C17H28N4O2/c1-21(2)13-15(14-9-5-3-6-10-14)20-16(22)11-7-4-8-12-19-17(18)23/h3,5-6,9-10,15H,4,7-8,11-13H2,1-2H3,(H,20,22)(H3,18,19,23)/p+1/t15-/m1/s1