[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl]-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl]-methyl-(2-phenoxyethyl)azanium Openeye Name: [2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxo-ethyl]-methyl-(2-phenoxyethyl)ammonium CAS Name: [2-[[(1R)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl]-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [2-[[(1R)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl]-methyl-(2-phenoxyethyl)azanium Traditional Name: [2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-keto-ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C17H24N3O2+ MolecularWeight: 302.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)C[NH+](C)CCOC2=CC=CC=C2

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)C[NH+](C)CCOC2=CC=CC=C2

InChI

InChI=1S/C17H23N3O2/c1-17(13-18,14-8-9-14)19-16(21)12-20(2)10-11-22-15-6-4-3-5-7-15/h3-7,14H,8-12H2,1-2H3,(H,19,21)/p+1/t17-/m0/s1