[(2S)-2-cyanopropyl]-ethyl-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [(2S)-2-cyanopropyl]-ethyl-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [(2S)-2-cyanopropyl]-ethyl-[2-(2-methoxyanilino)-2-oxo-ethyl]ammonium CAS Name: [(2S)-2-cyanopropyl]-ethyl-[2-(2-methoxyanilino)-2-oxoethyl]ammonium IUPAC Name: [(2S)-2-cyanopropyl]-ethyl-[2-(2-methoxyanilino)-2-oxoethyl]azanium Traditional Name: [(2S)-2-cyanopropyl]-ethyl-[2-keto-2-(o-anisidino)ethyl]ammonium Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(C)C#N)CC(=O)NC1=CC=CC=C1OC

Isomeric SMILES

CC[NH+](C[C@H](C)C#N)CC(=O)NC1=CC=CC=C1OC

InChI

InChI=1S/C15H21N3O2/c1-4-18(10-12(2)9-16)11-15(19)17-13-7-5-6-8-14(13)20-3/h5-8,12H,4,10-11H2,1-3H3,(H,17,19)/p+1/t12-/m1/s1