(3-cyanophenyl)methyl-[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: (3-cyanophenyl)methyl-[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: (3-cyanophenyl)methyl-[(1S)-2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (3-cyanophenyl)methyl-[(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: (3-cyanophenyl)methyl-[(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]-methylazanium Traditional Name: (3-cyanobenzyl)-[(1S)-2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C15H21N4O2+ MolecularWeight: 289.35284

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)[NH+](C)CC1=CC=CC(=C1)C#N

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)[NH+](C)CC1=CC=CC(=C1)C#N

InChI

InChI=1S/C15H20N4O2/c1-4-17-15(21)18-14(20)11(2)19(3)10-13-7-5-6-12(8-13)9-16/h5-8,11H,4,10H2,1-3H3,(H2,17,18,20,21)/p+1/t11-/m0/s1