[(2S)-1-[(5-azanyl-2-methoxy-phenyl)amino]-1-oxidanylidene-propan-2-yl]-(2-cyanoethyl)-methyl-azanium

Systemtic Name: [(2S)-1-[(5-azanyl-2-methoxy-phenyl)amino]-1-oxidanylidene-propan-2-yl]-(2-cyanoethyl)-methyl-azanium Openeye Name: [(1S)-2-(5-amino-2-methoxy-anilino)-1-methyl-2-oxo-ethyl]-(2-cyanoethyl)-methyl-ammonium CAS Name: [(2S)-1-(5-amino-2-methoxyanilino)-1-oxopropan-2-yl]-(2-cyanoethyl)-methylammonium IUPAC Name: [(2S)-1-(5-amino-2-methoxyanilino)-1-oxopropan-2-yl]-(2-cyanoethyl)-methylazanium Traditional Name: [(1S)-2-(5-amino-2-methoxy-anilino)-2-keto-1-methyl-ethyl]-(2-cyanoethyl)-methyl-ammonium Formula: C14H21N4O2+ MolecularWeight: 277.34214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)N)OC)[NH+](C)CCC#N

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=CC(=C1)N)OC)[NH+](C)CCC#N

InChI

InChI=1S/C14H20N4O2/c1-10(18(2)8-4-7-15)14(19)17-12-9-11(16)5-6-13(12)20-3/h5-6,9-10H,4,8,16H2,1-3H3,(H,17,19)/p+1/t10-/m0/s1