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

Systemtic Name: [(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-methyl-(3-phenoxypropyl)azanium Openeye Name: [(1S)-2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl]-methyl-(3-phenoxypropyl)ammonium CAS Name: [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]-methyl-(3-phenoxypropyl)ammonium IUPAC Name: [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]-methyl-(3-phenoxypropyl)azanium Traditional Name: [(1S)-2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl]-methyl-(3-phenoxypropyl)ammonium Formula: C16H26N3O3+ MolecularWeight: 308.39594

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)[NH+](C)CCCOC1=CC=CC=C1

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)[NH+](C)CCCOC1=CC=CC=C1

InChI

InChI=1S/C16H25N3O3/c1-4-17-16(21)18-15(20)13(2)19(3)11-8-12-22-14-9-6-5-7-10-14/h5-7,9-10,13H,4,8,11-12H2,1-3H3,(H2,17,18,20,21)/p+1/t13-/m0/s1