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

Systemtic Name: [(2S)-1-(cyclopropylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-methyl-(3-phenoxypropyl)azanium Openeye Name: [(1S)-2-(cyclopropylcarbamoylamino)-1-methyl-2-oxo-ethyl]-methyl-(3-phenoxypropyl)ammonium CAS Name: [(2S)-1-[[(cyclopropylamino)-oxomethyl]amino]-1-oxopropan-2-yl]-methyl-(3-phenoxypropyl)ammonium IUPAC Name: [(2S)-1-(cyclopropylcarbamoylamino)-1-oxopropan-2-yl]-methyl-(3-phenoxypropyl)azanium Traditional Name: [(1S)-2-(cyclopropylcarbamoylamino)-2-keto-1-methyl-ethyl]-methyl-(3-phenoxypropyl)ammonium Formula: C17H26N3O3+ MolecularWeight: 320.40664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CC1)[NH+](C)CCCOC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC1CC1)[NH+](C)CCCOC2=CC=CC=C2

InChI

InChI=1S/C17H25N3O3/c1-13(16(21)19-17(22)18-14-9-10-14)20(2)11-6-12-23-15-7-4-3-5-8-15/h3-5,7-8,13-14H,6,9-12H2,1-2H3,(H2,18,19,21,22)/p+1/t13-/m0/s1