[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl]-[(4-ethylphenyl)methyl]-methyl-azanium

Systemtic Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl]-[(4-ethylphenyl)methyl]-methyl-azanium Openeye Name: (4-ethylphenyl)methyl-methyl-[2-[[(1R)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl]ammonium CAS Name: [2-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl]-[(4-ethylphenyl)methyl]-methylammonium IUPAC Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl]-[(4-ethylphenyl)methyl]-methylazanium Traditional Name: (4-ethylbenzyl)-[2-keto-2-[[(1R)-1-methylpropyl]carbamoylamino]ethyl]-methyl-ammonium Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)NC(=O)NC(C)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)NC(=O)N[C@H](C)CC

InChI

InChI=1S/C17H27N3O2/c1-5-13(3)18-17(22)19-16(21)12-20(4)11-15-9-7-14(6-2)8-10-15/h7-10,13H,5-6,11-12H2,1-4H3,(H2,18,19,21,22)/p+1/t13-/m1/s1